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CHEBI:43496 - CEFUROXIME (OCT-3-ENE FORM)

Default Structure
ChEBI IDCHEBI:43496
ChEBI NameCEFUROXIME (OCT-3-ENE FORM)
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC16H16N4O8S
Net Charge0
Average Mass424.391
Monoisotopic Mass424.06888
SMILES[H]OC(=O)[C@@]1([H])C(C([H])([H])OC(=O)N([H])[H])=C([H])S[C@@]2([H])N1C(=O)[C@@]2([H])N([H])C(=O)/C(=N\OC([H])([H])[H])c1oc([H])c([H])c1[H]
InChIInChI=1S/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,6,10-11,14H,5H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,11-,14-/m1/s1
InChIKeyAIEMBSSBMKFDGU-HPUGUEDKSA-N
ChEBI Ontology
Outgoing Relation(s)
CEFUROXIME (OCT-3-ENE FORM) (CHEBI:43496) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(2R,6R,7R)-3-[(carbamoyloxy)methyl]-7-{[(2Z)-2-furan-2-yl-2-(methoxyimino)acetyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acidPDBeChem
CEFUROXIME (OCT-3-ENE FORM)PDBeChem
Manual XrefsDatabases
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