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CHEBI:207723 - Leopolic acid A

ChEBI IDCHEBI:207723
ChEBI NameLeopolic acid A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H43N3O6
Net Charge0
Average Mass529.678
Monoisotopic Mass529.31519
SMILESCCCCCCCCCCC1=C(O)C(=O)N(C(=O)[C@@H](NC(=O)N[C@@H](Cc2ccccc2)C(=O)O)C(C)C)C1
InChIInChI=1S/C29H43N3O6/c1-4-5-6-7-8-9-10-14-17-22-19-32(27(35)25(22)33)26(34)24(20(2)3)31-29(38)30-23(28(36)37)18-21-15-12-11-13-16-21/h11-13,15-16,20,23-24,33H,4-10,14,17-19H2,1-3H3,(H,36,37)(H2,30,31,38)/t23-,24-/m0/s1
InChIKeyBSVQYPWIIRMJLD-ZEQRLZLVSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - DOI (10.1016/j.tetlet.2012.09.046)
ChEBI Ontology
Outgoing Relation(s)
Leopolic acid A (CHEBI:207723) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
(2S)-2-[[(2S)-1-(3-decyl-4-hydroxy-5-oxo-2H-pyrrol-1-yl)-3-methyl-1-oxobutan-2-yl]carbamoylamino]-3-phenylpropanoic acid
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