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Substance Name: Kaimonolide A
RN: 126456-03-9
InChIKey: BNVZCZJOQPRHLO-OMGSKEOWSA-N

Molecular Formula

  • C40-H68-O12

Molecular Weight

  • 740.965
 
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Names and Synonyms

Results Name

  • Kaimonolide A

Synonyms

  • Kaimonolide A
  • NK 154168

Systematic Name

  • Cytovaricin, 12-de((2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl)oxy)-

Registry Numbers

CAS Registry Number

  • 126456-03-9

Other Registry Number

  • 126516-12-9

System Generated Number

  • 0126456039

Structure Descriptors

InChI

1S/C40H68O12/c1-8-29(41)19-31-25(3)13-17-39(51-31)21-32-27(5)33(52-39)22-40(48)28(18-24(2)23-49-40)12-10-9-11-15-37(6,46)34(43)20-30(42)26(4)36(45)38(7,47)16-14-35(44)50-32/h10,12,14,16,24-34,36,41-43,45-48H,8-9,11,13,15,17-23H2,1-7H3/b12-10-,16-14+

InChIKey

BNVZCZJOQPRHLO-OMGSKEOWSA-N

Smiles

C1[C@@H]([C@@H](O[C@@]2(C1)O[C@@H]1[C@@H]([C@@H](OC(=O)C=C[C@@](C)([C@@H]([C@@H](C)[C@@H](O)C[C@@H]([C@@](CCCC=C[C@@H]3C[C@@H](CO[C@@]3(C1)O)C)(C)O)O)O)O)C2)C)C[C@@H](CC)O)C