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Substance Name: Weinbersterol disulfate A
RN: 134515-53-0
InChIKey: DNLPVXFQHZAMAQ-KRENUUKMSA-N

Molecular Formula

  • C30-H52-O10-S2

Molecular Weight

  • 636.8628
 
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Names and Synonyms

Results Name

  • Weinbersterol disulfate A

Synonyms

  • Sterol HB99
  • Weinbersterol disulfate A

Systematic Name

  • 24-Norcholane-2,3,16,20-tetrol, 23-(2-methyl-1-(1-methylethyl)cyclopropyl)-, 2,3-bis(hydrogen sulfate), (2beta,3alpha,5alpha,16beta,20xi)-

Registry Numbers

CAS Registry Number

  • 134515-53-0

System Generated Number

  • 0134515530

Structure Descriptors

InChI

1S/C30H52O10S2/c1-17(2)30(15-18(30)3)12-11-29(6,32)26-23(31)14-22-20-8-7-19-13-24(39-41(33,34)35)25(40-42(36,37)38)16-28(19,5)21(20)9-10-27(22,26)4/h17-26,31-32H,7-16H2,1-6H3,(H,33,34,35)(H,36,37,38)/t18?,19-,20?,21?,22?,23-,24-,25-,26-,27-,28-,29?,30?/m0/s1

InChIKey

DNLPVXFQHZAMAQ-KRENUUKMSA-N

Smiles

CC1CC1(CCC(C)([C@H]2[C@H](CC3[C@@]2(CCC4C3CC[C@@H]5[C@@]4(C[C@@H]([C@H](C5)OS(=O)(=O)O)OS(=O)(=O)O)C)C)O)O)C(C)C