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CHEBI:51770 - sultamicillin

ChEBI IDCHEBI:51770
ChEBI Namesultamicillin
Stars
Last Modified22 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC25H30N4O9S2
Net Charge0
Average Mass594.668
Monoisotopic Mass594.14542
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)OCOC(=O)[C@@H]3N4C(=O)C[C@@]4([H])S(=O)(=O)C3(C)C)N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C25H30N4O9S2/c1-24(2)17(29-20(32)16(21(29)39-24)27-19(31)15(26)12-8-6-5-7-9-12)22(33)37-11-38-23(34)18-25(3,4)40(35,36)14-10-13(30)28(14)18/h5-9,14-18,21H,10-11,26H2,1-4H3,(H,27,31)/t14-,15-,16-,17+,18+,21-/m1/s1
InChIKeyOPYGFNJSCUDTBT-PMLPCWDUSA-N
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
sultamicillin (CHEBI:51770) has functional parent ampicillin (CHEBI:28971)
sultamicillin (CHEBI:51770) has functional parent sulbactam (CHEBI:9321)
sultamicillin (CHEBI:51770) is a penicillanic acid ester (CHEBI:51212)
Incoming Relation(s)
sultamicillin tosylate (CHEBI:32170) has part sultamicillin (CHEBI:51770)
IUPAC Name 
({6β-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3α-carbonyl}oxy)methyl 2,2-dimethylpenam-3α-carboxylate 1,1-dioxide
INN  Source
sultamicillinChemIDplus
Synonyms  Source
[(2,2-dimethyl-1,1-dioxidopenam-3α-carbonyl)oxy]methyl 6β-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3α-carboxylateIUPAC
sultamicilinaChemIDplus
sultamicillinumChemIDplus
VD 1827ChemIDplus
Manual XrefsDatabases
2539DrugCentral
DE3018590Patent
US4244951Patent
ZA8001885Patent
Registry NumbersSources
Beilstein:8958037Beilstein
CAS:76497-13-7ChemIDplus