(3α,21β)-A′-Neogammacer-22(29)-en-3-ol

CAS Registry Number®

18610-71-4

CAS Name

(3α,21β)-A′-Neogammacer-22(29)-en-3-ol

Molecular Formula

C30H50O

Molecular Mass

426.72

Cite this Page

(3α,21β)-A′-Neogammacer-22(29)-en-3-ol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=18610-71-4 (retrieved 2024-11-22) (CAS RN: 18610-71-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    223-224 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H50O/c1-19(2)20-11-15-27(5)21(20)12-17-29(7)23(27)9-10-24-28(6)16-14-25(31)26(3,4)22(28)13-18-30(24,29)8/h20-25,31H,1,9-18H2,2-8H3/t20-,21-,22-,23+,24+,25+,27-,28-,29+,30+/m0/s1

InChIKey

InChIKey=LFPVZIIPFONRSW-TXHKNKHWSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@](CC1)(C(C)(C)[C@H](O)CC3)[H])(CC[C@]4([C@@]2(C)CC[C@@]5([C@]4(C)CC[C@H]5C(C)=C)[H])[H])[H]

Canonical SMILES

OC1CCC2(C)C(CCC3(C)C2CCC4C5(C)CCC(C(=C)C)C5CCC43C)C1(C)C

Other Names for this Substance

  • A′-Neogammacer-22(29)-en-3-ol, (3α,21β)-
  • A′-Neo-21αH-gammacer-22(29)-en-3α-ol
  • (3α,21β)-A′-Neogammacer-22(29)-en-3-ol
  • 3-Epimoretenol
  • Epimoretenol

CAS INSIGHTSTM
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