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Substance Name: 3-Hydroxycholesta-5,8,22-trien-7-one
RN: 121714-74-7
InChIKey: AYNFEPVYJBGXLS-ODMVIQNVSA-N

Molecular Formula

  • C27-H40-O2

Molecular Weight

  • 396.611
 
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Names and Synonyms

Name of Substance

  • 3-Hydroxycholesta-5,8,22-trien-7-one

Synonym

  • 3-Hcto

Systematic Name

  • Cholesta-5,8,22-trien-7-one, 3-hydroxy-, (3beta,22E)-

Registry Numbers

CAS Registry Number

  • 121714-74-7

System Generated Number

  • 0121714747

Structure Descriptors

InChI

1S/C27H40O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h6,8,16-18,20-22,28H,7,9-15H2,1-5H3/b8-6+/t18-,20+,21-,22+,26+,27-/m1/s1

InChIKey

AYNFEPVYJBGXLS-ODMVIQNVSA-N

Smiles

C[C@H](/C=C/CC(C)C)[C@H]1CC[C@@H]2[C@@]1(CCC3=C2C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C)C