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Substance Name: Butanoic acid, 4-((6-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxohexyl)amino)-
RN: 150840-72-5
InChIKey: OMZJXSYZKMQYMJ-KUFQZFQGSA-N

Molecular Formula

  • C40-H66-N2-O5

Molecular Weight

  • 654.9704
 
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Names and Synonyms

Synonym

  • N'-(N-(3beta-Hydroxylup-20(29)-en-28-oyl)-6-aminohexanoyl)-4-aminobutyric acid

Systematic Name

  • Butanoic acid, 4-((6-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxohexyl)amino)-

Registry Numbers

CAS Registry Number

  • 150840-72-5

System Generated Number

  • 0150840725

Structure Descriptors

InChI

1S/C40H66N2O5/c1-26(2)27-16-21-40(35(47)42-24-10-8-9-12-32(44)41-25-11-13-33(45)46)23-22-38(6)28(34(27)40)14-15-30-37(5)19-18-31(43)36(3,4)29(37)17-20-39(30,38)7/h27-31,34,43H,1,8-25H2,2-7H3,(H,41,44)(H,42,47)(H,45,46)/t27-,28+,29-,30+,31-,34+,37-,38+,39+,40-/m0/s1

InChIKey

OMZJXSYZKMQYMJ-KUFQZFQGSA-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)NCCCCCC(=O)NCCCC(=O)O