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Substance Name: 3,11-Dioxo-18,22-cycloergosta-4,6,8(14)-triene-9beta,23S-diol
RN: 209673-38-1
InChIKey: FHVPLUBHHVAIQD-DDCZUTDHSA-N

Note

  • Analogue of Mer-NF8054X.

Molecular Formula

  • C28-H40-O4

Molecular Weight

  • 440.62
 
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Names and Synonyms

Synonym

  • Emesterone B

Systematic Name

  • 3,11-Dioxo-18,22-cycloergosta-4,6,8(14)-triene-9beta,23S-diol

Registry Numbers

CAS Registry Number

  • 209673-38-1

System Generated Number

  • 0209673381

Structure Descriptors

InChI

1S/C28H40O4/c1-15(2)16(3)25(31)20-13-27-14-24(30)28(32)23(22(27)9-8-21(27)17(20)4)7-6-18-12-19(29)10-11-26(18,28)5/h6-7,15-18,20-21,25,31-32H,8-14H2,1-5H3/t16-,17-,18?,20-,21-,25+,26+,27?,28-/m1/s1

InChIKey

FHVPLUBHHVAIQD-DDCZUTDHSA-N

Smiles

C[C@H]1[C@H]2CCC3=C4C=CC5CC(=O)CC[C@@]5([C@@]4(C(=O)CC23C[C@H]1[C@H]([C@H](C)C(C)C)O)O)C