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CHEBI:226421 - Vatiamide F

ChEBI IDCHEBI:226421
ChEBI NameVatiamide F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H39BrClN3O3
Net Charge0
Average Mass544.962
Monoisotopic Mass543.18633
SMILESCC(C)[C@@H](C(N)=O)N(C)C(=O)[C@@H](C)NC(=O)CCC=C[C@H](C)CCC(=CCl)CCCC#CBr
InChIInChI=1S/C25H39BrClN3O3/c1-18(2)23(24(28)32)30(5)25(33)20(4)29-22(31)13-9-8-11-19(3)14-15-21(17-27)12-7-6-10-16-26/h8,11,17-20,23H,6-7,9,12-15H2,1-5H3,(H2,28,32)(H,29,31)/t19-,20+,23-/m0/s1
InChIKeyCVGGVCHALSWETH-MZKRTTBSSA-N
Species of MetaboliteComponentSourceComments
Ianmoorea (ncbitaxon:619344) - PubMed (31071229)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Vatiamide F (CHEBI:226421) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
(6R)-N-[(2R)-1-[[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]-methylamino]-1-oxopropan-2-yl]-14-bromo-9-(chloromethylidene)-6-methyltetradec-4-en-13-ynamide