CHEBI:3494 - Cefoperazone sodium

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ChEBI Name Cefoperazone sodium
ChEBI ID CHEBI:3494
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H26N9O8S2.Na
Net Charge 0
Average Mass 667.652
Monoisotopic Mass 667.12435
InChI InChI=1S/C25H27N9O8S2.Na/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2;/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42)(H,40,41);/q;+1/p-1/t15-,16-,22-;/m1./s1
InChIKey NCFTXMQPRQZFMZ-WERGMSTESA-M
SMILES [Na+].CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SCC(CSc4nnnn4C)=C(N3C2=O)C([O-])=O)c2ccc(O)cc2)C(=O)C1=O
ChEBI Ontology
Outgoing Cefoperazone sodium (CHEBI:3494) is a organic molecular entity (CHEBI:50860)
Synonym Source
Cefoperazone sodium KEGG COMPOUND
Manual Xrefs Databases
C08112 KEGG COMPOUND
D00918 KEGG DRUG
View more database links
Registry Number Type Source
62893-20-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014