Ponasterone A

CAS Registry Number®

13408-56-5

CAS Name

Ponasterone A

Molecular Formula

C27H44O6

Molecular Mass

464.63

Cite this Page

Ponasterone A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13408-56-5 (retrieved 2024-11-22) (CAS RN: 13408-56-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    259-260 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C27H44O6/c1-15(2)6-7-23(31)26(5,32)22-9-11-27(33)17-12-19(28)18-13-20(29)21(30)14-24(18,3)16(17)8-10-25(22,27)4/h12,15-16,18,20-23,29-33H,6-11,13-14H2,1-5H3/t16-,18-,20+,21-,22-,23+,24+,25+,26+,27+/m0/s1

InChIKey

InChIKey=PJYYBCXMCWDUAZ-JJJZTNILSA-N

SMILES

O[C@]12C=3[C@@]([C@]4(C)[C@](C(=O)C3)(C[C@@H](O)[C@@H](O)C4)[H])(CC[C@]1(C)[C@@]([C@@]([C@@H](CCC(C)C)O)(C)O)(CC2)[H])[H]

Canonical SMILES

O=C1C=C2C(CCC3(C)C(CCC23O)C(O)(C)C(O)CCC(C)C)C4(C)CC(O)C(O)CC14

Other Names for this Substance

  • Cholest-7-en-6-one, 2,3,14,20,22-pentahydroxy-, (2β,3β,5β,22R)-
  • 5β-Cholest-7-en-6-one, 2β,3β,14,20,22-pentahydroxy-, (22R)-
  • (2β,3β,5β,22R)-2,3,14,20,22-Pentahydroxycholest-7-en-6-one
  • Ponasterone A
  • 25-Deoxyecdysterone

Deleted or Replaced CAS Registry Numbers

11001-60-8, 29391-04-6

CAS INSIGHTSTM
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