moxalactam (CHEBI:599928)

CHEBI:599928 - moxalactam

ChEBI ID	CHEBI:599928
ChEBI Name	moxalactam
Stars
Definition	A broad-spectrum oxacephem antibiotic in which the oxazine ring is substituted with a tetrazolylthiomethyl group and the azetidinone ring carries methoxy and 2-carboxy-2-(4-hydroxyphenyl)acetamido substituents.
Secondary ChEBI IDs	CHEBI:7006, CHEBI:44113, CHEBI:214506
Last Modified	13 February 2018
Downloads	Molfile

Formula	C20H20N6O9S
Net Charge	0
Average Mass	520.480
Monoisotopic Mass	520.10125
SMILES	[H][C@]12OCC(CSc3nnnn3C)=C(C(=O)O)N1C(=O)[C@]2(NC(=O)C(C(=O)O)c1ccc(O)cc1)OC
InChI	InChI=1S/C20H20N6O9S/c1-25-19(22-23-24-25)36-8-10-7-35-18-20(34-2,17(33)26(18)13(10)16(31)32)21-14(28)12(15(29)30)9-3-5-11(27)6-4-9/h3-6,12,18,27H,7-8H2,1-2H3,(H,21,28)(H,29,30)(H,31,32)/t12?,18-,20+/m1/s1
InChIKey	JWCSIUVGFCSJCK-CAVRMKNVSA-N

Roles Classification

antibacterial drug A drug used to treat or prevent bacterial infections.

drug allergen Any drug which causes the onset of an allergic reaction.

antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.

antibacterial drug A drug used to treat or prevent bacterial infections.

drug allergen Any drug which causes the onset of an allergic reaction.

ChEBI Ontology

Outgoing Relation(s)
	moxalactam (CHEBI:599928) has role antibacterial drug (CHEBI:36047)
	moxalactam (CHEBI:599928) is a cephalosporin (CHEBI:23066)
	moxalactam (CHEBI:599928) is a oxacephem (CHEBI:55506)

IUPAC Name
(6R,7R)-7-{[carboxy(4-hydroxyphenyl)acetyl]amino}-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

INNs	Source
latamoxefum	ChemIDplus
latamoxef	ChemIDplus

Registry Numbers	Sources
Reaxys:4222777	Reaxys
CAS:64952-97-2	ChemIDplus

Citations