(3bR,5aR,6S,9aR,9bR)-3b,4,5,5a,6,7,8,9,9a,9b,10,11-Dodecahydro-3b,6,9a-trimethylphenanthro[1,2-c]furan-6-carboxylic acid

CAS Registry Number®

74813-86-8

CAS Name

(3bR,5aR,6S,9aR,9bR)-3b,4,5,5a,6,7,8,9,9a,9b,10,11-Dodecahydro-3b,6,9a-trimethylphenanthro[1,2-c]furan-6-carboxylic acid

Molecular Formula

C20H28O3

Molecular Mass

316.43

Cite this Page

(3bR,5aR,6S,9aR,9bR)-3b,4,5,5a,6,7,8,9,9a,9b,10,11-Dodecahydro-3b,6,9a-trimethylphenanthro[1,2-c]furan-6-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=74813-86-8 (retrieved 2025-01-07) (CAS RN: 74813-86-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H28O3/c1-18-10-7-16-19(2,8-4-9-20(16,3)17(21)22)15(18)6-5-13-11-23-12-14(13)18/h11-12,15-16H,4-10H2,1-3H3,(H,21,22)/t15-,16+,18-,19+,20-/m0/s1

InChIKey

InChIKey=KJCLDWYEUKTPNA-ZRSLWSEBSA-N

SMILES

C[C@@]12[C@@]3([C@](C)(C=4C(CC3)=COC4)CC[C@]1([C@](C(O)=O)(C)CCC2)[H])[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C3CCC4=COC=C4C3(C)CCC12

Other Names for this Substance

  • Phenanthro[1,2-c]furan-6-carboxylic acid, 3b,4,5,5a,6,7,8,9,9a,9b,10,11-dodecahydro-3b,6,9a-trimethyl-, (3bR,5aR,6S,9aR,9bR)-
  • 18-Nor-16-oxaandrosta-13(17),14-diene-4-carboxylic acid, 4,8-dimethyl-, (4β,5α)-
  • (3bR,5aR,6S,9aR,9bR)-3b,4,5,5a,6,7,8,9,9a,9b,10,11-Dodecahydro-3b,6,9a-trimethylphenanthro[1,2-c]furan-6-carboxylic acid
  • Spongia-13(16),14-diene-19-oic acid
  • Spongia-13(16),14-dien-19-oic acid

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