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Substance Name: Anthrasteroid 1
RN: 120542-29-2
InChIKey: HGULMTJPHPUFCN-WKCWRMMGSA-N

Molecular Formula

  • C19-H26-O2

Molecular Weight

  • 286.412
 
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Names and Synonyms

Results Name

  • Anthrasteroid 1

Name of Substance

  • 3-Hydroxy-3,6-dimethyl-2,3,3,4,5,8,9,10,10,11,11,11-dodecahydro-1H-cyclopenta(a)anthracene-8-one

Synonyms

  • 3beta-Hydroxy-3alpha,beta,6-dimethyl-2,3,3a,4,5,8,9,10,10abeta,11,11abeta,11balpha-dodecahydro-1H-cyclopenta(a)anthracene-8-one
  • Anthrasteroid 1

Systematic Name

  • 1,6-Cyclo-1,10-secoandrosta-4,9-dien-3-one, 17-hydroxy-, (6beta,17beta)-

Registry Numbers

CAS Registry Number

  • 120542-29-2

System Generated Number

  • 0120542292

Structure Descriptors

InChI

1S/C19H26O2/c1-11-14-7-8-19(2)17(5-6-18(19)21)16(14)9-12-3-4-13(20)10-15(11)12/h10,12,16-18,21H,3-9H2,1-2H3/t12-,16+,17-,18-,19-/m0/s1

InChIKey

HGULMTJPHPUFCN-WKCWRMMGSA-N

Smiles

C1(CC[C@@H]2C(=C1)C(=C1CC[C@@]3([C@H](CC[C@@H]3[C@H]1C2)O)C)C)=O