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Substance Name: L-Proline, 1-(8-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)-
RN: 150840-65-6
InChIKey: VWQVAKKFKMOWQC-LXUHRDAJSA-N

Molecular Formula

  • C43-H70-N2-O5

Molecular Weight

  • 695.035
 
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Names and Synonyms

Synonym

  • N'-(N-(3beta-Hydroxylup-20(29)-en-28-oyl)-8-aminooctanoyl)-L-proline

Systematic Name

  • L-Proline, 1-(8-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)-

Registry Numbers

CAS Registry Number

  • 150840-65-6

System Generated Number

  • 0150840656

Structure Descriptors

InChI

1S/C43H70N2O5/c1-28(2)29-18-23-43(38(50)44-26-12-10-8-9-11-15-35(47)45-27-13-14-31(45)37(48)49)25-24-41(6)30(36(29)43)16-17-33-40(5)21-20-34(46)39(3,4)32(40)19-22-42(33,41)7/h29-34,36,46H,1,8-27H2,2-7H3,(H,44,50)(H,48,49)/t29-,30+,31-,32-,33+,34-,36+,40-,41+,42+,43-/m0/s1

InChIKey

VWQVAKKFKMOWQC-LXUHRDAJSA-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)NCCCCCCCC(=O)N6CCC[C@H]6C(=O)O