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Substance Name: Lupenone
RN: 1617-70-5
InChIKey: GRBHNQFQFHLCHO-BHMAJAPKSA-N

Molecular Formula

  • C30-H48-O

Molecular Weight

  • 424.708
 
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Names and Synonyms

Name of Substance

  • Lupenone

Synonyms

  • Lup-20(30)-en-3-one
  • Lupenone
  • NSC 281807

Systematic Name

  • Lup-20(29)-en-3-one

Registry Numbers

CAS Registry Number

  • 1617-70-5

System Generated Number

  • 0001617705

Structure Descriptors

InChI

1S/C30H48O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-23,25H,1,9-18H2,2-8H3/t20-,21+,22-,23+,25+,27+,28-,29+,30+/m0/s1

InChIKey

GRBHNQFQFHLCHO-BHMAJAPKSA-N

Smiles

O=C1C([C@@H]2CC[C@@]3([C@@]4(CC[C@@]5(CC[C@H]([C@H]5[C@H]4CC[C@H]3[C@@]2(CC1)C)C(=C)C)C)C)C)(C)C