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Substance Name: Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-
RN: 92594-07-5
InChIKey: FELCJAPFJOPHSD-PGROKZIJSA-N

Molecular Formula

  • C30-H48-O2

Molecular Weight

  • 440.707
 
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Names and Synonyms

Synonym

  • 3-Epibetulinic aldehyde

Systematic Name

  • Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-

Registry Numbers

CAS Registry Number

  • 92594-07-5

System Generated Number

  • 0092594075

Structure Descriptors

InChI

1S/C30H48O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h18,20-25,32H,1,8-17H2,2-7H3/t20-,21+,22-,23+,24+,25+,27-,28+,29+,30+/m0/s1

InChIKey

FELCJAPFJOPHSD-PGROKZIJSA-N

Smiles

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