3β,5α-Dihydroxy(22E,24R)-ergosta-7,22-dien-6-one

CAS Registry Number®

14858-07-2
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CAS Name

3β,5α-Dihydroxy(22E,24R)-ergosta-7,22-dien-6-one

Molecular Formula

C28H44O3

Molecular Mass

428.65

Cite this Page

3β,5α-Dihydroxy(22E,24R)-ergosta-7,22-dien-6-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=14858-07-2 (retrieved 2024-04-28) (CAS RN: 14858-07-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    250 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C28H44O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-24,29,31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23-,24-,26+,27+,28-/m0/s1

InChIKey

InChIKey=KAIVGEVOBNIWLR-QIBDZGQISA-N

SMILES

C[C@@]12[C@@]3(C([C@]4([C@](C)(CC3)[C@@]([C@@H](/C=C/[C@@H](C(C)C)C)C)(CC4)[H])[H])=CC(=O)[C@@]1(O)C[C@@H](O)CC2)[H]

Canonical SMILES

O=C1C=C2C3CCC(C(C=CC(C)C(C)C)C)C3(C)CCC2C4(C)CCC(O)CC14O

Other Names for this Substance

  • Ergosta-7,22-dien-6-one, 3,5-dihydroxy-, (3β,5α,22E)-
  • 5α-Ergosta-7,22-dien-6-one, 3β,5-dihydroxy-
  • (3β,5α,22E)-3,5-Dihydroxyergosta-7,22-dien-6-one
  • 5α-Ergosta-7,22-diene-3β,5α-diol-6-one
  • 3β,5α-Dihydroxy(22E,24R)-ergosta-7,22-dien-6-one

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