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CHEBI:214121 - Azacoccone H

ChEBI IDCHEBI:214121
ChEBI NameAzacoccone H
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FormulaC18H17NO6
Net Charge0
Average Mass343.335
Monoisotopic Mass343.10559
SMILESCc1c(O)c(O)c(O)c2c1C(=O)N([C@@H](Cc1ccccc1)C(=O)O)C2
InChIInChI=1S/C18H17NO6/c1-9-13-11(15(21)16(22)14(9)20)8-19(17(13)23)12(18(24)25)7-10-5-3-2-4-6-10/h2-6,12,20-22H,7-8H2,1H3,(H,24,25)/t12-/m0/s1
InChIKeyDOAJHSIXAWZIKS-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Epicoccum (ncbitaxon:104397) - PubMed (32745508)
ChEBI Ontology
Outgoing Relation(s)
Azacoccone H (CHEBI:214121) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
(2S)-3-phenyl-2-(5,6,7-trihydroxy-4-methyl-3-oxo-1H-isoindol-2-yl)propanoic acid