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Substance Name: Neoporrigenin B
RN: 196607-74-6
InChIKey: BTSHHJQHTVNSLW-LSLZVYMXSA-N

Molecular Formula

  • C27-H42-O5

Molecular Weight

  • 446.6238
 
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Names and Synonyms

Results Name

  • Neoporrigenin B

Synonym

  • (-)-Neoporrigenin B

Systematic Name

  • Spirostan-2-one, 3,6-dihydroxy-, (3beta,5alpha,6beta,25S)-

Registry Numbers

CAS Registry Number

  • 196607-74-6

System Generated Number

  • 0196607746

Structure Descriptors

InChI

1S/C27H42O5/c1-14-5-8-27(31-13-14)15(2)24-23(32-27)11-18-16-9-20(28)19-10-21(29)22(30)12-26(19,4)17(16)6-7-25(18,24)3/h14-21,23-24,28-29H,5-13H2,1-4H3/t14-,15-,16+,17-,18-,19+,20+,21+,23-,24-,25-,26+,27+/m0/s1

InChIKey

BTSHHJQHTVNSLW-LSLZVYMXSA-N

Smiles

C[C@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4C[C@H]([C@@H]6[C@@]5(CC(=O)[C@@H](C6)O)C)O)C)C)OC1