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

CAS Registry Number®

26263-39-8

CAS Name

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

Molecular Formula

C20H30O2

Molecular Mass

302.45

Cite this Page

(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-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=26263-39-8 (retrieved 2024-11-04) (CAS RN: 26263-39-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    128-131 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H30O2/c1-17-6-4-7-18(2,16(21)22)14(17)5-8-20-10-13-12(9-15(17)20)19(13,3)11-20/h12-15H,4-11H2,1-3H3,(H,21,22)/t12?,13-,14-,15-,17+,18-,19+,20-/m0/s1

InChIKey

InChIKey=FLGAFUAMEXILLB-MVYJNYASSA-N

SMILES

C[C@]12[C@]3([C@@]4(C[C@]5(C)[C@](C3)([C@@]5(C4)[H])[H])CC[C@@]1([C@](C(O)=O)(C)CCC2)[H])[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34CC5C(CC32)C5(C)C4

Other Names for this Substance

  • 6a,8-Methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid, tetradecahydro-4,7a,9b-trimethyl-, (4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-
  • Trachyloban-18-oic acid, (4β)-
  • (4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid
  • Trachyloban-19-oic acid
  • Trachylobanic acid

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CAS INSIGHTSTM
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