(3R,3aS,5aS,8R,10aS,10bS)-2,3,4,5,5a,6,7,8,10a,10b-Decahydro-8-hydroxy-5a,8-dimethyl-3-(1-methylethyl)cyclohept[e]indene-3a(1H)-carboxylic acid

CAS Registry Number®

182353-88-4
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CAS Name

(3R,3aS,5aS,8R,10aS,10bS)-2,3,4,5,5a,6,7,8,10a,10b-Decahydro-8-hydroxy-5a,8-dimethyl-3-(1-methylethyl)cyclohept[e]indene-3a(1H)-carboxylic acid

Molecular Formula

C20H32O3

Molecular Mass

320.47

Cite this Page

(3R,3aS,5aS,8R,10aS,10bS)-2,3,4,5,5a,6,7,8,10a,10b-Decahydro-8-hydroxy-5a,8-dimethyl-3-(1-methylethyl)cyclohept[e]indene-3a(1H)-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=182353-88-4 (retrieved 2024-09-19) (CAS RN: 182353-88-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H32O3/c1-13(2)14-5-6-16-15-7-8-19(4,23)11-9-18(15,3)10-12-20(14,16)17(21)22/h7-8,13-16,23H,5-6,9-12H2,1-4H3,(H,21,22)/t14-,15+,16+,18-,19+,20+/m1/s1

InChIKey

InChIKey=LRZJASNGRXSNCR-MXFTUIMMSA-N

SMILES

C(O)(=O)[C@@]12[C@]([C@]3([C@@](C)(CC1)CC[C@@](C)(O)C=C3)[H])(CC[C@@H]2C(C)C)[H]

Canonical SMILES

O=C(O)C12CCC3(C)CCC(O)(C=CC3C2CCC1C(C)C)C

Other Names for this Substance

  • Cyclohept[e]indene-3a(1H)-carboxylic acid, 2,3,4,5,5a,6,7,8,10a,10b-decahydro-8-hydroxy-5a,8-dimethyl-3-(1-methylethyl)-, (3R,3aS,5aS,8R,10aS,10bS)-
  • Cyclohept[e]indene-3a(1H)-carboxylic acid, 2,3,4,5,5a,6,7,8,10a,10b-decahydro-8-hydroxy-5a,8-dimethyl-3-(1-methylethyl)-, [3R-(3α,3aα,5aα,8β,10aα,10bβ)]-
  • (3R,3aS,5aS,8R,10aS,10bS)-2,3,4,5,5a,6,7,8,10a,10b-Decahydro-8-hydroxy-5a,8-dimethyl-3-(1-methylethyl)cyclohept[e]indene-3a(1H)-carboxylic acid
  • Mulinolic acid