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CHEBI:177737 - lamifiban

ChEBI IDCHEBI:177737
ChEBI Namelamifiban
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H28N4O6
Net Charge0
Average Mass468.510
Monoisotopic Mass468.20088
SMILESN=C(N)c1ccc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC(OCC(=O)O)CC2)cc1
InChIInChI=1S/C24H28N4O6/c25-22(26)16-3-5-17(6-4-16)23(32)27-20(13-15-1-7-18(29)8-2-15)24(33)28-11-9-19(10-12-28)34-14-21(30)31/h1-8,19-20,29H,9-14H2,(H3,25,26)(H,27,32)(H,30,31)/t20-/m0/s1
InChIKeyFPKOGTAFKSLZLD-FQEVSTJZSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
lamifiban (CHEBI:177737) is a N-acylglycine (CHEBI:16180)
IUPAC Name 
2-[1-[(2S)-2-[(4-carbamimidoylbenzoyl)amino]-3-(4-hydroxyphenyl)propanoyl]piperidin-4-yl]oxyacetic acid
Manual XrefsDatabases
2302049ChemSpider
D04659KEGG DRUG
Registry NumbersSources
CAS:144412-49-7ChemIDplus