25-Deoxyecdysone

CAS Registry Number®

22005-50-1

CAS Name

25-Deoxyecdysone

Molecular Formula

C27H44O5

Molecular Mass

448.64

Cite this Page

25-Deoxyecdysone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22005-50-1 (retrieved 2024-11-29) (CAS RN: 22005-50-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H44O5/c1-15(2)6-7-21(28)16(3)17-9-11-27(32)19-12-22(29)20-13-23(30)24(31)14-25(20,4)18(19)8-10-26(17,27)5/h12,15-18,20-21,23-24,28,30-32H,6-11,13-14H2,1-5H3/t16-,17+,18-,20-,21+,23+,24-,25+,26+,27+/m0/s1

InChIKey

InChIKey=HHQGPNBMKUXKRM-JUJQDXCZSA-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@@H]([C@@H](CCC(C)C)O)C)(CC2)[H])[H]

Canonical SMILES

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

Other Names for this Substance

  • Cholest-7-en-6-one, 2,3,14,22-tetrahydroxy-, (2β,3β,5β,22R)-
  • 5β-Cholest-7-en-6-one, 2β,3β,14,22-tetrahydroxy-, (20S,22R)-
  • (2β,3β,5β,22R)-2,3,14,22-Tetrahydroxycholest-7-en-6-one
  • 25-Deoxyecdysone
  • 25-Deoxy-α-ecdysone

CAS INSIGHTSTM
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