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Substance Name: Shidasterone
RN: 26361-67-1
InChIKey: JWXMXJQGIRXWDG-SASGHFKCSA-N

Note

  • Phytoecdysone isolated from Blechnum niponicum; insect metamorphosing substance.

Molecular Formula

  • C27-H42-O6

Molecular Weight

  • 462.6228
 
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Names and Synonyms

Name of Substance

  • Shidasterone

Synonym

  • 22,25-Oxido-5beta-cholest-7-en-6-one-2beta,3beta,14alpha,20-tetrol

Systematic Name

  • Cholest-7-en-6-one, 22,25-epoxy-2,3,14,20-tetrahydroxy-, (2beta,3beta,5beta)- (VAN)

Registry Numbers

CAS Registry Number

  • 26361-67-1

System Generated Number

  • 0026361671

Structure Descriptors

InChI

1S/C27H42O6/c1-23(2)9-8-22(33-23)26(5,31)21-7-11-27(32)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-32H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22?,24+,25+,26+,27+/m0/s1

InChIKey

JWXMXJQGIRXWDG-SASGHFKCSA-N

Smiles

C[C@](O)(C1CCC(C)(C)O1)[C@H]2CC[C@@]3(O)C4=CC(=O)[C@@H]5C[C@@H](O)[C@@H](O)C[C@]5(C)[C@H]4CC[C@]23C