(4R,4aS,6aR,7R,7aR,8S,8aR,9aS,9bS)-Tetradecahydro-7-hydroxy-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid

CAS Registry Number®

83404-76-6

CAS Name

(4R,4aS,6aR,7R,7aR,8S,8aR,9aS,9bS)-Tetradecahydro-7-hydroxy-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid

Molecular Formula

C20H30O3

Molecular Mass

318.45

Cite this Page

(4R,4aS,6aR,7R,7aR,8S,8aR,9aS,9bS)-Tetradecahydro-7-hydroxy-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83404-76-6 (retrieved 2024-11-08) (CAS RN: 83404-76-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H30O3/c1-17-6-4-7-18(2,16(22)23)13(17)5-8-20-10-12-11(9-14(17)20)19(12,3)15(20)21/h11-15,21H,4-10H2,1-3H3,(H,22,23)/t11?,12-,13-,14-,15-,17+,18+,19+,20+/m0/s1

InChIKey

InChIKey=MHVNHDYWKUKRRJ-URHDRXJLSA-N

SMILES

O[C@@H]1[C@]23[C@]([C@@]4(C)[C@](CC2)([C@@](C(O)=O)(C)CCC4)[H])(C[C@]5([C@]1(C)[C@]5(C3)[H])[H])[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34CC5C(CC23)C5(C)C4O

Other Names for this Substance

  • 6a,8-Methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid, tetradecahydro-7-hydroxy-4,7a,9b-trimethyl-, (4R,4aS,6aR,7R,7aR,8S,8aR,9aS,9bS)-
  • Trachyloban-18-oic acid, 15-hydroxy-, (4α,15α)-
  • (4R,4aS,6aR,7R,7aR,8S,8aR,9aS,9bS)-Tetradecahydro-7-hydroxy-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid

CAS INSIGHTSTM
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