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CHEBI:218328 - Fusariumin B

ChEBI IDCHEBI:218328
ChEBI NameFusariumin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H47NO4
Net Charge0
Average Mass413.643
Monoisotopic Mass413.35051
SMILESCCCCCCCCCCC[C@@H](OC(=O)CCCCCCC)[C@@H](C)NCC(=O)O
InChIInChI=1S/C24H47NO4/c1-4-6-8-10-11-12-13-15-16-18-22(21(3)25-20-23(26)27)29-24(28)19-17-14-9-7-5-2/h21-22,25H,4-20H2,1-3H3,(H,26,27)/t21-,22-/m1/s1
InChIKeyAPRNIWNRXVDZQP-FGZHOGPDSA-N
Species of MetaboliteComponentSourceComments
Fusariumspecies (ncbitaxon:29916) - DOI (10.1177/1934578X1801300108)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Fusariumin B (CHEBI:218328) is a α-amino acid (CHEBI:33704)
IUPAC Name 
2-[[(2R,3R)-3-octanoyloxytetradecan-2-yl]amino]acetic acid