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CHEBI:201157 - Fusaristatin A

ChEBI IDCHEBI:201157
ChEBI NameFusaristatin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC36H58N4O7
Net Charge0
Average Mass658.881
Monoisotopic Mass658.43055
SMILESC=C1NC(=O)C(C)C(CCC(C)C(=O)/C=C/C(C)=C/CCC(C)CCCCCC)OC(=O)C(CCC(N)=O)NC(=O)C(C)CNC1=O
InChIInChI=1S/C36H58N4O7/c1-8-9-10-11-13-23(2)14-12-15-24(3)16-19-30(41)25(4)17-20-31-27(6)34(44)39-28(7)35(45)38-22-26(5)33(43)40-29(36(46)47-31)18-21-32(37)42/h15-16,19,23,25-27,29,31H,7-14,17-18,20-22H2,1-6H3,(H2,37,42)(H,38,45)(H,39,44)(H,40,43)/b19-16+,24-15+
InChIKeyMNMRSBPSTNMOQK-MAUBWLBLSA-N
Species of MetaboliteComponentSourceComments
Fusariumspecies (ncbitaxon:29916) - PubMed (17551209)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Fusaristatin A (CHEBI:201157) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
3-[6,13-dimethyl-10-methylidene-2,5,9,12-tetraoxo-14-[(5E,7E)-3,7,11-trimethyl-4-oxoheptadeca-5,7-dienyl]-1-oxa-4,8,11-triazacyclotetradec-3-yl]propanamide
Manual XrefsDatabases
28284183ChemSpider