CHEBI:31382 - Ceftezole Sodium

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ChEBI Name Ceftezole Sodium
ChEBI ID CHEBI:31382
Stars This entity has been manually annotated by a third party.
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Formulae C13H11N8NaO4S3
C13H11N8O4S3.Na
Net Charge 0
Average Mass 462.466
Monoisotopic Mass 461.99631
InChI InChI=1S/C13H12N8O4S3.Na/c22-7(1-20-4-14-18-19-20)16-8-10(23)21-9(12(24)25)6(2-26-11(8)21)3-27-13-17-15-5-28-13;/h4-5,8,11H,1-3H2,(H,16,22)(H,24,25);/q;+1/p-1/t8-,11-;/m1./s1
InChIKey UGUMHWUOXWFPFH-JHQAJZDGSA-M
SMILES [C@]12(N(C(=C(CS1)CSC3=NN=CS3)C(=O)[O-])C([C@H]2NC(=O)CN4C=NN=N4)=O)[H].[Na+]
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Ceftezole Sodium (CHEBI:31382) is a N-acyl-amino acid (CHEBI:51569)
Synonym Source
Ceftezole Sodium KEGG COMPOUND
Manual Xref Database
D01517 KEGG DRUG
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Registry Number Type Source
41136-22-5 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017