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CHEBI:219647 - Fumonisin AK1

ChEBI IDCHEBI:219647
ChEBI NameFumonisin AK1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H55NO10
Net Charge0
Average Mass601.778
Monoisotopic Mass601.38260
SMILESCCCCC(C)C(=O)C(CC(C)CC(O)CCCCC(O)CC(O)C(C)NC(C)=O)OC(=O)CC(CC(C)=O)C(=O)O
InChIInChI=1S/C31H55NO10/c1-7-8-11-20(3)30(39)28(42-29(38)17-24(31(40)41)16-21(4)33)15-19(2)14-25(35)12-9-10-13-26(36)18-27(37)22(5)32-23(6)34/h19-20,22,24-28,35-37H,7-18H2,1-6H3,(H,32,34)(H,40,41)
InChIKeyVNYJDROZXKTDTM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Fusarium proliferatum (ncbitaxon:948311) - DOI (10.1021/np50123a009)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Fumonisin AK1 (CHEBI:219647) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name 
2-[2-(19-acetamido-11,16,18-trihydroxy-5,9-dimethyl-6-oxoicosan-7-yl)oxy-2-oxoethyl]-4-oxopentanoic acid
Manual XrefsDatabases
78444591ChemSpider