9-Hydroxycerevisterol

CAS Registry Number®

88191-06-4
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CAS Name

9-Hydroxycerevisterol

Molecular Formula

C28H46O4

Molecular Mass

446.66

Cite this Page

9-Hydroxycerevisterol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88191-06-4 (retrieved 2024-09-19) (CAS RN: 88191-06-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    248-250 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C28H46O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28(32)16-20(29)11-12-26(28,6)27(23,31)14-13-25(21,22)5/h7-8,15,17-22,24,29-32H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,24+,25+,26+,27+,28-/m0/s1

InChIKey

InChIKey=NYMHFYDQBMRBMB-IUMXJWHTSA-N

SMILES

O[C@@]12C([C@]3([C@](C)(CC1)[C@@]([C@@H](/C=C/[C@@H](C(C)C)C)C)(CC3)[H])[H])=C[C@@H](O)[C@]4(O)[C@]2(C)CC[C@H](O)C4

Canonical SMILES

OC1C=C2C3CCC(C(C=CC(C)C(C)C)C)C3(C)CCC2(O)C4(C)CCC(O)CC14O

Other Names for this Substance

  • Ergosta-7,22-diene-3,5,6,9-tetrol, (3β,5α,6β,22E)-
  • (3β,5α,6β,22E)-Ergosta-7,22-diene-3,5,6,9-tetrol
  • (22E,24R)-Ergosta-7,22-diene-3β,5α,6β,9α-tetrol
  • (22E)-Ergosta-7,22-diene-3β,5α,6β,9α-tetraol
  • 9-Hydroxycerevisterol

Deleted or Replaced CAS Registry Numbers

125741-05-1