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CHEBI:204947 - Penipacid B

ChEBI IDCHEBI:204947
ChEBI NamePenipacid B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20N2O3
Net Charge0
Average Mass264.325
Monoisotopic Mass264.14739
SMILESCOC(C)(C)CN=C(C)Nc1ccccc1C(=O)O
InChIInChI=1S/C14H20N2O3/c1-10(15-9-14(2,3)19-4)16-12-8-6-5-7-11(12)13(17)18/h5-8H,9H2,1-4H3,(H,15,16)(H,17,18)
InChIKeyIFXNVCSTFQZQNI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (23966037)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Penipacid B (CHEBI:204947) is a benzoic acids (CHEBI:22723)
IUPAC Name 
2-[[N-(2-methoxy-2-methylpropyl)-C-methylcarbonimidoyl]amino]benzoic acid
Manual XrefsDatabases
30771322ChemSpider