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CHEBI:219064 - Inducamide A

ChEBI IDCHEBI:219064
ChEBI NameInducamide A
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FormulaC19H16Cl2N2O4
Net Charge0
Average Mass407.253
Monoisotopic Mass406.04871
SMILESCc1c(Cl)ccc(O)c1C(=O)N[C@@H](Cc1cnc2cc(Cl)ccc12)C(=O)O
InChIInChI=1S/C19H16Cl2N2O4/c1-9-13(21)4-5-16(24)17(9)18(25)23-15(19(26)27)6-10-8-22-14-7-11(20)2-3-12(10)14/h2-5,7-8,15,22,24H,6H2,1H3,(H,23,25)(H,26,27)/t15-/m0/s1
InChIKeyBKHFTNHFLNCCGT-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (25338006)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Inducamide A (CHEBI:219064) has functional parent N-benzoylglycine (CHEBI:18089)
Inducamide A (CHEBI:219064) is a N-acylglycine (CHEBI:16180)
IUPAC Name 
(2S)-2-[(3-chloro-6-hydroxy-2-methylbenzoyl)amino]-3-(6-chloro-1H-indol-3-yl)propanoic acid
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78440506ChemSpider