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Substance Name: Bengamide A
RN: 104947-68-4
InChIKey: NKASPYGDXVCCTA-LVZFUZTISA-N

Molecular Formula

  • C31-H56-N2-O8

Molecular Weight

  • 584.789
 
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Names and Synonyms

  • Bengamide A
  • NSSC 613012

Registry Numbers

CAS Registry Number

  • 104947-68-4

System Generated Number

  • 0104947684

Structure Descriptors

InChI

1S/C31H56N2O8/c1-5-6-7-8-9-10-11-12-13-14-15-16-26(35)41-23-18-19-24(30(38)32-21-23)33-31(39)29(40-4)28(37)27(36)25(34)20-17-22(2)3/h17,20,22-25,27-29,34,36-37H,5-16,18-19,21H2,1-4H3,(H,32,38)(H,33,39)/b20-17+

InChIKey

NKASPYGDXVCCTA-LVZFUZTISA-N

Smiles

C1C[C@@H](OC(=O)CCCCCCCCCCCCC)CNC([C@@H]1NC([C@@H](OC)[C@@H]([C@@H]([C@@H](\C=C\C(C)C)O)O)O)=O)=O