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CHEBI:228380 - ANH

ChEBI IDCHEBI:228380
ChEBI NameANH
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24N4O5S
Net Charge0
Average Mass432.502
Monoisotopic Mass432.14674
SMILESCOC(=O)[C@H](Cc1cccc(C(=N)N)c1)NC(=O)CNS(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C20H24N4O5S/c1-13-6-8-16(9-7-13)30(27,28)23-12-18(25)24-17(20(26)29-2)11-14-4-3-5-15(10-14)19(21)22/h3-10,17,23H,11-12H2,1-2H3,(H3,21,22)(H,24,25)/t17-/m0/s1
InChIKeyYAEIKQDHLCFGAA-KRWDZBQOSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
ANH (CHEBI:228380) is a peptide (CHEBI:16670)
IUPAC Name 
methyl (2S)-3-(3-carbamimidoylphenyl)-2-[[2-[(4-methylphenyl)sulonylamino]acetyl]amino]propanoate
Manual XrefsDatabases
116313ChemSpider
ANHPDBeChem
DB01737DrugBank