CHEBI:3492 - cefonicid sodium

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cefonicid sodium
ChEBI ID CHEBI:3492
Stars This entity has been manually annotated by the ChEBI Team.
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Formulae C18H16N6Na2O8S3
C18H16N6O8S3.2Na
Net Charge 0
Average Mass 586.53000
Monoisotopic Mass 585.999
InChI InChI=1S/C18H18N6O8S3.2Na/c25-13(9-4-2-1-3-5-9)14(26)19-11-15(27)24-12(17(28)29)10(6-33-16(11)24)7-34-18-20-21-22-23(18)8-35(30,31)32;;/h1-5,11,13,16,25H,6-8H2,(H,19,26)(H,28,29)(H,30,31,32);;/q;2*+1/p-2/t11-,13-,16-;;/m1../s1
InChIKey NAXFZVGOZUWLEP-RFXDPDBWSA-L
SMILES [Na+].[Na+].[H][C@]12SCC(CSc3nnnn3CS([O-])(=O)=O)=C(N1C(=O)[C@H]2NC(=O)[C@H](O)c1ccccc1)C([O-])=O
ChEBI Ontology
Outgoing cefonicid sodium (CHEBI:3492) has part cefonicid(2−) (CHEBI:52441)
cefonicid sodium (CHEBI:3492) is a organic sodium salt (CHEBI:38700)
Synonyms Sources
cefonicid disodium ChEBI
Cefonicid sodium KEGG COMPOUND
Manual Xrefs Databases
C08105 KEGG COMPOUND
D00912 KEGG DRUG
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Registry Number Type Source
61270-78-8 CAS Registry Number ChemIDplus
Last Modified
15 May 2009