Compound Identification
SMILES
COC1=CC=C(COC(=O)C2=CC(S[C@H]3[C@H](NC(=O)C(=N\O)\C4=CSC(N)=N4)C(=O)N23)C2=CSC3=CC=CC=C23)C=C1
InChIKey
InChIKey=GDOFRGXXQCICCH-LEFYTSGQSA-N
Formula
C28H23N5O6S3
Mass
621.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls 1-benzothiophenes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers 2,4-disubstituted thiazoles 1,3-thiazines 2-amino-1,3-thiazoles Ketoximes Tertiary carboxylic acid amides Heteroaromatic compounds Enoate esters Thiophenes Secondary carboxylic acid amides Azetidines Thiohemiaminal derivatives Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary amines Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - 1-benzothiophene - Benzothiophene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Meta-thiazine - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Benzenoid - Azole - Thiazole - Tertiary carboxylic acid amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Ketoxime - Thiophene - Heteroaromatic compound - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Amino acid or derivatives - Ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Dialkylthioether - Azacycle - Hemithioaminal - Thioether - Primary amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.
External Descriptors
Not available