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Substance Name: Marthasterone
RN: 36564-29-1
InChIKey: JMTGPYQQNHOZAL-GNGILNPGSA-N

Note

  • Principal aglycone from saponins of starfish, Marthasterias glacialis.

Molecular Weight

  • 414.626
 
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Names and Synonyms

Name of Substance

  • Marthasterone

Synonym

  • 3-beta,6alpha-Dihydroxy-5alpha-cholesta-9(11),24-dien-23-one

Systematic Name

  • (3beta,5alpha,6alpha)-3,6-Dihydroxy-cholesta-9(11),24-dien-23-one

Registry Numbers

CAS Registry Number

  • 36564-29-1

System Generated Number

  • 0036564291

Structure Descriptors

InChI

1S/C27H42O3/c1-16(2)12-19(29)13-17(3)21-6-7-22-20-15-25(30)24-14-18(28)8-10-27(24,5)23(20)9-11-26(21,22)4/h9,12,17-18,20-22,24-25,28,30H,6-8,10-11,13-15H2,1-5H3/t17-,18+,20+,21-,22+,24-,25+,26-,27-/m1/s1

InChIKey

JMTGPYQQNHOZAL-GNGILNPGSA-N

Smiles

C1[C@@H](C[C@@H]2[C@H](C[C@H]3[C@@H]4CC[C@@H]([C@@H](CC(\C=C(\C)C)=O)C)[C@@]4(C)CC=C3[C@@]2(C1)C)O)O