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Substance Name: Nepedinol
RN: 104139-53-9
InChIKey: RGQISYCPICNWAQ-AMZTXIEOSA-N

Molecular Formula

  • C30-H50-O4

Molecular Weight

  • 474.721
 
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Names and Synonyms

Results Name

  • Nepedinol

Synonyms

  • (-)-Nepedinol
  • Nepedinol

Systematic Name

  • Lup-20(30)-ene-1,3,11,29-tetrol, (1beta,3beta,11alpha)-

Registry Numbers

CAS Registry Number

  • 104139-53-9

System Generated Number

  • 0104139539

Structure Descriptors

InChI

1S/C30H50O4/c1-17(16-31)18-8-10-27(4)12-13-28(5)19(24(18)27)14-20(32)25-29(28,6)11-9-21-26(2,3)22(33)15-23(34)30(21,25)7/h18-25,31-34H,1,8-16H2,2-7H3/t18-,19+,20+,21-,22-,23+,24+,25-,27+,28+,29+,30+/m0/s1

InChIKey

RGQISYCPICNWAQ-AMZTXIEOSA-N

Smiles

C1[C@@H](C(C)(C)[C@@H]2CC[C@@]3(C)[C@]4(C)CC[C@@]5(C)CC[C@H](C(CO)=C)[C@H]5[C@H]4C[C@H]([C@H]3[C@@]2([C@@H]1O)C)O)O