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Substance Name: Polypodine B
RN: 18069-14-2
InChIKey: GMFLGNRCCFYOKL-ACCCYTKYSA-N

Note

  • An ecdysteroid from roots of Leuzea carthamoides.

Molecular Formula

  • C27-H44-O8

Molecular Weight

  • 496.6366
 
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Names and Synonyms

Name of Substance

  • Polypodine B

Synonyms

  • 2beta,3beta,5beta,14,20,22R,25-Heptahydroxycholest-7-en-6-one
  • 5beta-Hydroxyecdysterone
  • Ajugasterone A
  • Hydroxyecdysterone
  • Polypodine B
  • Polypodyne B

Systematic Name

  • Cholest-7-en-6-one, 2,3,5,14,20,22,25-heptahydroxy-, (2beta,3beta,5beta,22R)-

Registry Numbers

CAS Registry Number

  • 18069-14-2

Other Registry Numbers

  • 25318-50-7
  • 2877-75-4
  • 73416-57-6

System Generated Number

  • 0018069142

Structure Descriptors

InChI

1S/C27H44O8/c1-22(2,32)9-8-20(30)25(5,33)19-7-11-26(34)16-12-21(31)27(35)14-18(29)17(28)13-24(27,4)15(16)6-10-23(19,26)3/h12,15,17-20,28-30,32-35H,6-11,13-14H2,1-5H3/t15-,17-,18+,19-,20+,23+,24+,25+,26+,27+/m0/s1

InChIKey

GMFLGNRCCFYOKL-ACCCYTKYSA-N

Smiles

CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C