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Substance Name: Nonanoic acid, 9-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-
RN: 174740-43-3
InChIKey: VXHANRBEAHCGSY-PPBXDVGMSA-N

Molecular Formula

  • C39-H65-N-O4

Molecular Weight

  • 611.9455
 
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Names and Synonyms

Synonym

  • N-(3beta-Hydroxylup-20(29)-en-28-oyl)-9-aminonononanoic acid

Systematic Name

  • Nonanoic acid, 9-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-

Registry Numbers

CAS Registry Number

  • 174740-43-3

System Generated Number

  • 0174740433

Structure Descriptors

InChI

1S/C39H65NO4/c1-26(2)27-17-22-39(34(44)40-25-13-11-9-8-10-12-14-32(42)43)24-23-37(6)28(33(27)39)15-16-30-36(5)20-19-31(41)35(3,4)29(36)18-21-38(30,37)7/h27-31,33,41H,1,8-25H2,2-7H3,(H,40,44)(H,42,43)/t27-,28+,29-,30+,31-,33+,36-,37+,38+,39-/m0/s1

InChIKey

VXHANRBEAHCGSY-PPBXDVGMSA-N

Smiles

CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C(=O)NCCCCCCCCC(=O)O