Compound Identification
SMILES
COC1=CC=C(COC(=O)C2=C3CC([C@@H]3S[C@@H]3[C@H](NC(=O)CC4=CC=CC=C4)C(=O)N23)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=ULFWHIWHUBGWCO-MFIDKRJXSA-N
Formula
C37H32N2O5S
Mass
616.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
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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
Diphenylmethanes N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls Phenylacetamides Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers 1,3-thiazines Enoate esters Tertiary carboxylic acid amides Secondary carboxylic acid amides Azetidines Monocarboxylic acids and derivatives Thiohemiaminal derivatives Dialkylthioethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Diphenylmethane - Alpha-amino acid or derivatives - Phenylacetamide - Benzyloxycarbonyl - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Meta-thiazine - Enoate ester - Tertiary carboxylic acid amide - Alpha,beta-unsaturated carboxylic ester - Azetidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Ether - Thioether - Hemithioaminal - Carboxylic acid derivative - Dialkylthioether - Azacycle - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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