(3β,7β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-ene-3,7-diol

CAS Registry Number®

1338588-82-1
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CAS Name

(3β,7β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-ene-3,7-diol

Molecular Formula

C30H50O2

Molecular Mass

442.72

Cite this Page

(3β,7β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-ene-3,7-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1338588-82-1 (retrieved 2024-05-19) (CAS RN: 1338588-82-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H50O2/c1-18(2)19-9-10-22-28(19,6)15-16-30(8)25-20(11-14-29(22,30)7)27(5)13-12-24(32)26(3,4)23(27)17-21(25)31/h11,18-19,21-25,31-32H,9-10,12-17H2,1-8H3/t19-,21-,22-,23-,24-,25-,27+,28-,29+,30-/m0/s1

InChIKey

InChIKey=FQHMGDGIXBLTOA-KELKJMMRSA-N

SMILES

C[C@@]12[C@](C)([C@]3(C(=CC1)[C@]4(C)[C@@](C[C@@H]3O)(C(C)(C)[C@@H](O)CC4)[H])[H])CC[C@]5(C)[C@@]2(CC[C@H]5C(C)C)[H]

Canonical SMILES

OC1CC2C(C3=CCC4(C)C5CCC(C(C)C)C5(C)CCC4(C)C31)(C)CCC(O)C2(C)C

Other Names for this Substance

  • A′-Neo-26,28-dinorgammacer-9(11)-ene-3,7-diol, 13,17-dimethyl-, (3β,7β,21β)-
  • (3β,7β,21β)-13,17-Dimethyl-A′-neo-26,28-dinorgammacer-9(11)-ene-3,7-diol

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