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Substance Name: Xanthobaccin B
RN: 218296-14-1
UNII: F6E8P0RECD
InChIKey: ORNAXAMDOONKBX-LZNOBSJQSA-N

Molecular Formula

  • C29-H40-N2-O6

Molecular Weight

  • 512.643
 
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Names and Synonyms

Name of Substance

  • Xanthobaccin B

Synonyms

  • AFA-0520
  • UNII-F6E8P0RECD
  • Xanthobaccin B

Registry Numbers

CAS Registry Number

  • 218296-14-1

FDA UNII

  • F6E8P0RECD

System Generated Number

  • 0218296141

Structure Descriptors

InChI

1S/C29H40N2O6/c1-3-15-11-17-12-19-18-5-4-6-23(35)30-10-9-21(33)27-28(36)26(29(37)31-27)20(32)8-7-16(18)13-22(34)25(19)24(17)14(15)2/h4,6-8,14-19,21-22,24-25,27,33-34,36H,3,5,9-13H2,1-2H3,(H,30,35)(H,31,37)/b6-4-,8-7+/t14-,15-,16+,17-,18-,19+,21+,22?,24+,25-,27-/m0/s1

InChIKey

ORNAXAMDOONKBX-LZNOBSJQSA-N

Smiles

CC[C@H]1C[C@H]2C[C@@H]3[C@H]4C/C=C\C(=O)NCC[C@H]([C@H]5C(=C(C(=O)/C=C/[C@@H]4CC([C@H]3[C@@H]2[C@H]1C)O)C(=O)N5)O)O