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Triterpenoids

Triterpenoids

Compounds with a carbon skeleton based on six isoprene units that are derived biosynthetically from the acyclic C30 hydrocarbon, squalene. They have relatively complex cyclic structures, most being either alcohols, aldehydes or carboxylic acids.
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1 – 15 of 83 results
1

Celastrol, Tocris Bioscience™
GREENER_CHOICE

CAS: 34157-83-0 Molecular Formula: C29H38O4 Molecular Weight (g/mol): 450.62 MDL Number: MFCD03424073 InChI Key: KQJSQWZMSAGSHN-JJWQIEBTSA-N Synonym: celastrol,tripterine,tripterin,2r,4as,6as,12br,14as,14br-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid,triterpene,celastrol, celastrus scandens,unii-l8gg98663l,3-hydroxy-24-nor-2-oxo-1 10 ,3,5,7-friedelatetraen-29-oic acid,2r,4as,6ar,6as,14as,14br-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid,d:a-friedo-24-noroleana-1 10 ,3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, 20alpha PubChem CID: 122724 ChEBI: CHEBI:63959 IUPAC Name: (2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid SMILES: CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O

PubChem CID 122724
CAS 34157-83-0
Molecular Weight (g/mol) 450.62
ChEBI CHEBI:63959
MDL Number MFCD03424073
SMILES CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O
Synonym celastrol,tripterine,tripterin,2r,4as,6as,12br,14as,14br-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid,triterpene,celastrol, celastrus scandens,unii-l8gg98663l,3-hydroxy-24-nor-2-oxo-1 10 ,3,5,7-friedelatetraen-29-oic acid,2r,4as,6ar,6as,14as,14br-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid,d:a-friedo-24-noroleana-1 10 ,3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, 20alpha
IUPAC Name (2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid
InChI Key KQJSQWZMSAGSHN-JJWQIEBTSA-N
Molecular Formula C29H38O4
2

Oleanolic acid, 97%, Thermo Scientific Chemicals

CAS: 508-02-1 Molecular Formula: C30H48O3 Molecular Weight (g/mol): 456.7 InChI Key: MIJYXULNPSFWEK-GTOFXWBISA-N Synonym: oleanolic acid,oleanic acid,caryophyllin,astrantiagenin c,giganteumgenin c,virgaureagenin b,3beta-hydroxyolean-12-en-28-oic acid,unii-6smk8r7tgj,ccris 6493,oleanolic_acid PubChem CID: 10494 ChEBI: CHEBI:37659 IUPAC Name: (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid SMILES: CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C

PubChem CID 10494
CAS 508-02-1
Molecular Weight (g/mol) 456.7
ChEBI CHEBI:37659
SMILES CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
Synonym oleanolic acid,oleanic acid,caryophyllin,astrantiagenin c,giganteumgenin c,virgaureagenin b,3beta-hydroxyolean-12-en-28-oic acid,unii-6smk8r7tgj,ccris 6493,oleanolic_acid
IUPAC Name (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChI Key MIJYXULNPSFWEK-GTOFXWBISA-N
Molecular Formula C30H48O3
3

Squalane, Spectrum™ Chemical
SDP

CAS: 111-01-3

CAS 111-01-3
4

Forskolin, 98+%, Thermo Scientific Chemicals

CAS: 66575-29-9 Molecular Formula: C22H34O7 Molecular Weight (g/mol): 410.507 MDL Number: MFCD00082317 InChI Key: OHCQJHSOBUTRHG-KGGHGJDLSA-N Synonym: forskolin,colforsin,coleonol,colforsina,colforsine,colforsinum,boforsin,colforsine french,colforsinum latin,colforsina spanish PubChem CID: 47936 ChEBI: CHEBI:42471 IUPAC Name: [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate SMILES: CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O

PubChem CID 47936
CAS 66575-29-9
Molecular Weight (g/mol) 410.507
ChEBI CHEBI:42471
MDL Number MFCD00082317
SMILES CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O
Synonym forskolin,colforsin,coleonol,colforsina,colforsine,colforsinum,boforsin,colforsine french,colforsinum latin,colforsina spanish
IUPAC Name [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate
InChI Key OHCQJHSOBUTRHG-KGGHGJDLSA-N
Molecular Formula C22H34O7
5

Betulin, 95.2%, MP Biomedicals™

CAS: 473-98-3 Molecular Formula: C30H50O2 Molecular Weight (g/mol): 442.728 InChI Key: FVWJYYTZTCVBKE-ROUWMTJPSA-N Synonym: betulin,betulinol,betuline,trochol,betulol,lup-20 29-ene-3b,28-diol,lup-20 29-ene-3beta,28-diol,unii-6w70hn7x7o,lup-20 30-ene-3beta,28-diol,lup-20 29-ene-3,28-diol, 3beta PubChem CID: 72326 ChEBI: CHEBI:3086 IUPAC Name: (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol SMILES: CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO

PubChem CID 72326
CAS 473-98-3
Molecular Weight (g/mol) 442.728
ChEBI CHEBI:3086
SMILES CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO
Synonym betulin,betulinol,betuline,trochol,betulol,lup-20 29-ene-3b,28-diol,lup-20 29-ene-3beta,28-diol,unii-6w70hn7x7o,lup-20 30-ene-3beta,28-diol,lup-20 29-ene-3,28-diol, 3beta
IUPAC Name (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol
InChI Key FVWJYYTZTCVBKE-ROUWMTJPSA-N
Molecular Formula C30H50O2
6

beta-Sitosterol Acetate (contains Campesterol Acetate) 40.0+%, TCI America™
SDP

CAS: 915-05-9 Molecular Formula: C31H52O2 Molecular Weight (g/mol): 456.755 MDL Number: MFCD00083497 InChI Key: PBWOIPCULUXTNY-LBKBYZTLSA-N PubChem CID: 5354503 ChEBI: CHEBI:69433 IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate SMILES: CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)C(C)C

PubChem CID 5354503
CAS 915-05-9
Molecular Weight (g/mol) 456.755
ChEBI CHEBI:69433
MDL Number MFCD00083497
SMILES CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)C(C)C
IUPAC Name [(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
InChI Key PBWOIPCULUXTNY-LBKBYZTLSA-N
Molecular Formula C31H52O2
7

Squalene, >98%, MP Biomedicals™

CAS: 111-02-4 Molecular Formula: C30H50 Molecular Weight (g/mol): 410.73 InChI Key: YYGNTYWPHWGJRM-AAJYLUCBSA-N Synonym: squalene,trans-squalene,spinacene,supraene,all-trans-squalene,2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene,e,e,e,e-squalene,unii-7qwm220fjh,7qwm220fjh,spinacen PubChem CID: 638072 ChEBI: CHEBI:15440 IUPAC Name: (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene SMILES: CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C

PubChem CID 638072
CAS 111-02-4
Molecular Weight (g/mol) 410.73
ChEBI CHEBI:15440
SMILES CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C
Synonym squalene,trans-squalene,spinacene,supraene,all-trans-squalene,2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene,e,e,e,e-squalene,unii-7qwm220fjh,7qwm220fjh,spinacen
IUPAC Name (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
InChI Key YYGNTYWPHWGJRM-AAJYLUCBSA-N
Molecular Formula C30H50
8

Glycyrrhetic Acid 97.0+%, TCI America™
SDP

CAS: 471-53-4 Molecular Formula: C30H46O4 Molecular Weight (g/mol): 470.69 MDL Number: MFCD00003706,MFCD00066716 InChI Key: MPDGHEJMBKOTSU-YKLVYJNSSA-N Synonym: enoxolone,glycyrrhetinic acid,uralenic acid,glycyrrhetic acid,18-beta-glycyrrhetinic acid,glycyrrhetin,arthrodont,jintan,18beta-glycyrrhetinic acid,rhetinic acid PubChem CID: 10114 ChEBI: CHEBI:30853 IUPAC Name: (2S,4aS,6aS,6bR,8aR,10S,12aS,12bR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-2-carboxylic acid SMILES: CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O

PubChem CID 10114
CAS 471-53-4
Molecular Weight (g/mol) 470.69
ChEBI CHEBI:30853
MDL Number MFCD00003706,MFCD00066716
SMILES CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O
Synonym enoxolone,glycyrrhetinic acid,uralenic acid,glycyrrhetic acid,18-beta-glycyrrhetinic acid,glycyrrhetin,arthrodont,jintan,18beta-glycyrrhetinic acid,rhetinic acid
IUPAC Name (2S,4aS,6aS,6bR,8aR,10S,12aS,12bR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-2-carboxylic acid
InChI Key MPDGHEJMBKOTSU-YKLVYJNSSA-N
Molecular Formula C30H46O4
9

Squalane 98.0+%, TCI America™
SDP

CAS: 111-01-3 Molecular Formula: C30H62 Molecular Weight (g/mol): 422.826 MDL Number: MFCD00008953 InChI Key: PRAKJMSDJKAYCZ-UHFFFAOYSA-N Synonym: squalane,perhydrosqualene,dodecahydrosqualene,cosbiol,vitabiosol,spinacane,robane,hexamethyltetracosane,tetracosane, 2,6,10,15,19,23-hexamethyl,hexamethyl tetracosane PubChem CID: 8089 IUPAC Name: 2,6,10,15,19,23-hexamethyltetracosane SMILES: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

PubChem CID 8089
CAS 111-01-3
Molecular Weight (g/mol) 422.826
MDL Number MFCD00008953
SMILES CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C
Synonym squalane,perhydrosqualene,dodecahydrosqualene,cosbiol,vitabiosol,spinacane,robane,hexamethyltetracosane,tetracosane, 2,6,10,15,19,23-hexamethyl,hexamethyl tetracosane
IUPAC Name 2,6,10,15,19,23-hexamethyltetracosane
InChI Key PRAKJMSDJKAYCZ-UHFFFAOYSA-N
Molecular Formula C30H62
10

Oleanolic Acid, 98.4% (HPLC), MP Biomedicals

CAS: 508-02-1 Molecular Formula: C30H48O3 Molecular Weight (g/mol): 456.711 InChI Key: MIJYXULNPSFWEK-GTOFXWBISA-N Synonym: oleanolic acid,oleanic acid,caryophyllin,astrantiagenin c,giganteumgenin c,virgaureagenin b,3beta-hydroxyolean-12-en-28-oic acid,unii-6smk8r7tgj,ccris 6493,oleanolic_acid PubChem CID: 10494 ChEBI: CHEBI:37659 IUPAC Name: (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid SMILES: CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C

PubChem CID 10494
CAS 508-02-1
Molecular Weight (g/mol) 456.711
ChEBI CHEBI:37659
SMILES CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
Synonym oleanolic acid,oleanic acid,caryophyllin,astrantiagenin c,giganteumgenin c,virgaureagenin b,3beta-hydroxyolean-12-en-28-oic acid,unii-6smk8r7tgj,ccris 6493,oleanolic_acid
IUPAC Name (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChI Key MIJYXULNPSFWEK-GTOFXWBISA-N
Molecular Formula C30H48O3
11

Squalene, 98%, Thermo Scientific Chemicals

CAS: 111-02-4 Molecular Formula: C30H50 Molecular Weight (g/mol): 410.73 MDL Number: MFCD00008912 InChI Key: YYGNTYWPHWGJRM-AAJYLUCBSA-N Synonym: squalene,trans-squalene,spinacene,supraene,all-trans-squalene,2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene,e,e,e,e-squalene,unii-7qwm220fjh,7qwm220fjh,spinacen PubChem CID: 638072 ChEBI: CHEBI:15440 IUPAC Name: (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene SMILES: CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C

PubChem CID 638072
CAS 111-02-4
Molecular Weight (g/mol) 410.73
ChEBI CHEBI:15440
MDL Number MFCD00008912
SMILES CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C
Synonym squalene,trans-squalene,spinacene,supraene,all-trans-squalene,2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene,e,e,e,e-squalene,unii-7qwm220fjh,7qwm220fjh,spinacen
IUPAC Name (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
InChI Key YYGNTYWPHWGJRM-AAJYLUCBSA-N
Molecular Formula C30H50
12

Squalane, NF, 97-102%, Spectrum™ Chemical
SDP

CAS: 111-01-3 Molecular Formula: C30H62 Molecular Weight (g/mol): 422.83 InChI Key: PRAKJMSDJKAYCZ-UHFFFAOYNA-N IUPAC Name: 2,6,10,15,19,23-hexamethyltetracosane SMILES: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

CAS 111-01-3
Molecular Weight (g/mol) 422.83
SMILES CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C
IUPAC Name 2,6,10,15,19,23-hexamethyltetracosane
InChI Key PRAKJMSDJKAYCZ-UHFFFAOYNA-N
Molecular Formula C30H62
13

Squalene, 99%, Spectrum™ Chemical
SDP

CAS: 111-02-4

CAS 111-02-4
14

Celastrol 98.0+%, TCI America™
SDP

CAS: 34157-83-0 Molecular Formula: C29H38O4 Molecular Weight (g/mol): 450.62 MDL Number: MFCD03424073 InChI Key: KQJSQWZMSAGSHN-JJWQIEBTSA-N Synonym: celastrol,tripterine,tripterin,2r,4as,6as,12br,14as,14br-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid,triterpene,celastrol, celastrus scandens,unii-l8gg98663l,3-hydroxy-24-nor-2-oxo-1 10 ,3,5,7-friedelatetraen-29-oic acid,2r,4as,6ar,6as,14as,14br-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid,d:a-friedo-24-noroleana-1 10 ,3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, 20alpha PubChem CID: 122724 ChEBI: CHEBI:63959 IUPAC Name: (2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid SMILES: CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O

PubChem CID 122724
CAS 34157-83-0
Molecular Weight (g/mol) 450.62
ChEBI CHEBI:63959
MDL Number MFCD03424073
SMILES CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O
Synonym celastrol,tripterine,tripterin,2r,4as,6as,12br,14as,14br-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid,triterpene,celastrol, celastrus scandens,unii-l8gg98663l,3-hydroxy-24-nor-2-oxo-1 10 ,3,5,7-friedelatetraen-29-oic acid,2r,4as,6ar,6as,14as,14br-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid,d:a-friedo-24-noroleana-1 10 ,3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, 20alpha
IUPAC Name (2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylic acid
InChI Key KQJSQWZMSAGSHN-JJWQIEBTSA-N
Molecular Formula C29H38O4
15

Forskolin, (from Coleus forskohlii), MP Biomedicals™

CAS: 66575-29-9 Molecular Formula: C22H34O7 Molecular Weight (g/mol): 410.507 MDL Number: MFCD00082317 InChI Key: OHCQJHSOBUTRHG-KGGHGJDLSA-N Synonym: forskolin,colforsin,coleonol,colforsina,colforsine,colforsinum,boforsin,colforsine french,colforsinum latin,colforsina spanish PubChem CID: 47936 ChEBI: CHEBI:42471 IUPAC Name: [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate SMILES: CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O

PubChem CID 47936
CAS 66575-29-9
Molecular Weight (g/mol) 410.507
ChEBI CHEBI:42471
MDL Number MFCD00082317
SMILES CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O
Synonym forskolin,colforsin,coleonol,colforsina,colforsine,colforsinum,boforsin,colforsine french,colforsinum latin,colforsina spanish
IUPAC Name [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate
InChI Key OHCQJHSOBUTRHG-KGGHGJDLSA-N
Molecular Formula C22H34O7