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Substance Name: Fumonisin B2
RN: 116355-84-1
InChIKey: UXDPXZQHTDAXOZ-STOIETHLSA-N

Note

  • Produced by Fusarium moniliforme MRC 826; has cancer-promoting ability.

Classification Codes

  • Carcinogens
  • Carcinogens, Environmental
  • Environmental Pollutants
  • Noxae
  • Tumor Data

Molecular Formula

  • C34-H59-N-O14

Molecular Weight

  • 705.8331
 
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Names and Synonyms

Name of Substance

  • Fumonisin B2

Synonyms

  • CCRIS 4434
  • Fumonisin B2

Systematic Names

  • 1,2,3-Propanetricarboxylic acid, 1,1'-(1-(12-amino-9,11-dihydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl) ester
  • 1,2,3-Propanetricarboxylic acid, 1,1'-(1-(2-amino-9,11-dihydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl) ester
  • Fumonisin B2

Superlist Name

  • Fumonisin B2

Registry Numbers

CAS Registry Number

  • 116355-84-1

System Generated Number

  • 0116355841

Structure Descriptors

InChI

1S/C34H59NO14/c1-5-6-12-21(3)32(49-31(43)18-24(34(46)47)16-29(40)41)27(48-30(42)17-23(33(44)45)15-28(38)39)14-20(2)11-9-7-8-10-13-25(36)19-26(37)22(4)35/h20-27,32,36-37H,5-19,35H2,1-4H3,(H,38,39)(H,40,41)(H,44,45)(H,46,47)/t20-,21+,22-,23+,24+,25+,26-,27-,32+/m0/s1

InChIKey

UXDPXZQHTDAXOZ-STOIETHLSA-N

Smiles

O([C@@H]([C@@H](OC(C[C@@H](CC(O)=O)C(O)=O)=O)C[C@@H](CCCCCC[C@@H](C[C@@H]([C@@H](C)N)O)O)C)[C@@H](CCCC)C)C(C[C@@H](CC(O)=O)C(O)=O)=O