(2β,3β,5β,22R)-2,3,20,22,25-Pentahydroxycholesta-8,14-dien-6-one

CAS Registry Number®

22612-27-7

CAS Name

(2β,3β,5β,22R)-2,3,20,22,25-Pentahydroxycholesta-8,14-dien-6-one

Molecular Formula

C27H42O6

Molecular Mass

462.62

Cite this Page

(2β,3β,5β,22R)-2,3,20,22,25-Pentahydroxycholesta-8,14-dien-6-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22612-27-7 (retrieved 2024-11-22) (CAS RN: 22612-27-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H42O6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,18,20-23,29-33H,7-14H2,1-5H3/t18-,20+,21-,22-,23+,25-,26+,27+/m0/s1

InChIKey

InChIKey=AEFMTBQZWMUASH-IILZZRPCSA-N

SMILES

C[C@@]12C3=C(C=4[C@](C)(CC3)[C@@]([C@@]([C@@H](CCC(C)(C)O)O)(C)O)(CC4)[H])CC(=O)[C@@]1(C[C@@H](O)[C@@H](O)C2)[H]

Canonical SMILES

O=C1CC=2C3=CCC(C(O)(C)C(O)CCC(O)(C)C)C3(C)CCC2C4(C)CC(O)C(O)CC14

Other Names for this Substance

  • Cholesta-8,14-dien-6-one, 2,3,20,22,25-pentahydroxy-, (2β,3β,5β,22R)-
  • 5β-Cholesta-8,14-dien-6-one, 2β,3β,20,22,25-pentahydroxy-, (22R)-
  • (2β,3β,5β,22R)-2,3,20,22,25-Pentahydroxycholesta-8,14-dien-6-one
  • Podecdysone B

CAS INSIGHTSTM
Targeted protein degrader structure, illustration