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Substance Name: Hetisan-6,13-diol, (13S)-
RN: 115610-48-5
InChIKey: ZEHGKQGMRGFJOC-DUUFESMZSA-N

Molecular Formula

  • C20-H27-N-O2

Molecular Weight

  • 313.438
 
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Names and Synonyms

Synonym

  • Spirasine XIV

Systematic Name

  • Hetisan-6,13-diol, (13S)-

Registry Numbers

CAS Registry Number

  • 115610-48-5

System Generated Number

  • 0115610485

Structure Descriptors

InChI

1S/C20H27NO2/c1-10-7-18-8-20(23)16-17(2)4-3-5-19(16)12(18)6-11(10)14(22)13(18)15(19)21(20)9-17/h11-16,22-23H,1,3-9H2,2H3/t11-,12+,13+,14?,15?,16+,17-,18?,19?,20-/m0/s1

InChIKey

ZEHGKQGMRGFJOC-DUUFESMZSA-N

Smiles

O[C@]12[C@@H]3[C@@]4(CCC[C@@]53[C@@H]([C@@H]3[C@@]6(CC([C@@H](C[C@@H]56)[C@H]3O)=C)C1)[N@@]2C4)C