CHEBI:51770 - sultamicillin

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ChEBI Name sultamicillin
ChEBI ID CHEBI:51770
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C25H30N4O9S2
Net Charge 0
Average Mass 594.65926
Monoisotopic Mass 594.145
InChI InChI=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
InChIKey OPYGFNJSCUDTBT-PMLPCWDUSA-N
SMILES [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1)C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@@]2([H])S(=O)(=O)C1(C)C
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
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ChEBI Ontology
Outgoing 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 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
sultamicillin ChemIDplus
Synonyms Sources
[(2,2-dimethyl-1,1-dioxidopenam-3α-carbonyl)oxy]methyl 6β-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3α-carboxylate IUPAC
sultamicilina ChemIDplus
sultamicillinum ChemIDplus
VD 1827 ChemIDplus
Manual Xrefs Databases
2539 DrugCentral
DE3018590 Patent
US4244951 Patent
ZA8001885 Patent
View more database links
Registry Numbers Types Sources
76497-13-7 CAS Registry Number ChemIDplus
8958037 Beilstein Registry Number Beilstein
Last Modified
22 February 2017