CHEBI:6537 - loracarbef monohydrate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name loracarbef monohydrate
ChEBI ID CHEBI:6537
Definition The monohydrated form of loracarbef.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H16ClN3O4.H2O
Net Charge 0
Average Mass 367.785
Monoisotopic Mass 367.09350
InChI InChI=1S/C16H16ClN3O4.H2O/c17-9-6-7-10-12(15(22)20(10)13(9)16(23)24)19-14(21)11(18)8-4-2-1-3-5-8;/h1-5,10-12H,6-7,18H2,(H,19,21)(H,23,24);1H2/t10?,11-,12?;/m1./s1
InChIKey GPYKKBAAPVOCIW-HZKXUOCSSA-N
SMILES O.N[C@@H](C(=O)NC1C2CCC(Cl)=C(N2C1=O)C(O)=O)c1ccccc1
ChEBI Ontology
Outgoing loracarbef monohydrate (CHEBI:6537) is a organic molecular entity (CHEBI:50860)
Synonym Source
Loracarbef KEGG COMPOUND
Manual Xrefs Databases
C08109 KEGG COMPOUND
D00916 KEGG DRUG
View more database links
Registry Number Type Source
121961-22-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014