(3S,5R,8S,9S,10S,13R,14S,17R)-1,3,4,8,10,11,13,14,15,16-Decahydro-17-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexen-1-yl]-4,4,13,14-tetramethyl-5,9-(epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol

CAS Registry Number®

81910-41-0
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CAS Name

(3S,5R,8S,9S,10S,13R,14S,17R)-1,3,4,8,10,11,13,14,15,16-Decahydro-17-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexen-1-yl]-4,4,13,14-tetramethyl-5,9-(epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol

Molecular Formula

C30H48O3

Molecular Mass

456.70

Cite this Page

(3S,5R,8S,9S,10S,13R,14S,17R)-1,3,4,8,10,11,13,14,15,16-Decahydro-17-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexen-1-yl]-4,4,13,14-tetramethyl-5,9-(epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=81910-41-0 (retrieved 2024-05-02) (CAS RN: 81910-41-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H48O3/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)22-13-16-30-23(10-11-24(31)26(30,4)5)29(22,19-33-30)18-17-27(21,28)6/h8,13-14,16,20-24,31-32H,9-12,15,17-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27-,28+,29+,30-/m1/s1

InChIKey

InChIKey=GDWGKJJMMBZZDX-ITPHIMIFSA-N

SMILES

C[C@]12[C@]3([C@]4([C@]5([C@](OC4)(C=C3)C(C)(C)[C@@H](O)CC5)[H])CC[C@]1(C)[C@@]([C@@H](C/C=C/C(C)(C)O)C)(CC2)[H])[H]

Canonical SMILES

OC1CCC2C3(OCC42CCC5(C)C(CCC5(C)C4C=C3)C(C)CC=CC(O)(C)C)C1(C)C

Other Names for this Substance

  • 5,9-(Epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol, 1,3,4,8,10,11,13,14,15,16-decahydro-17-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexen-1-yl]-4,4,13,14-tetramethyl-, (3S,5R,8S,9S,10S,13R,14S,17R)-
  • 5,9-(Epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol, 1,3,4,8,10,11,13,14,15,16-decahydro-17-(5-hydroxy-1,5-dimethyl-3-hexenyl)-4,4,13,14-tetramethyl-, [3S-[3α,5α,8α,9α,10β,13α,14β,17α(1S*,3E)]]-
  • 5,9-(Epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol, 1,3,4,8,10,11,13,14,15,16-decahydro-17-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexenyl]-4,4,13,14-tetramethyl-, (3S,5R,8S,9S,10S,13R,14S,17R)-
  • (3S,5R,8S,9S,10S,13R,14S,17R)-1,3,4,8,10,11,13,14,15,16-Decahydro-17-[(1R,3E)-5-hydroxy-1,5-dimethyl-3-hexen-1-yl]-4,4,13,14-tetramethyl-5,9-(epoxymethano)-2H-cyclopenta[a]phenanthren-3-ol
  • (23E)-5β,19-Epoxycucurbita-6,23-diene-3β,25-diol

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