Compound Identification
SMILES
[O-]C(=O)C(Cl)Cl.[O-]C(=O)C(Cl)Cl.COC1=CC=C(COC(=O)C2=C(CS[C@@H]3[C@H](NC(=O)CSCCN=C(N)N)C(=O)N23)SC2=C(CSC(N)=[NH2+])C=C(CSC(N)=[NH2+])C=C2)C=C1
InChIKey
InChIKey=UAZLTCQRWNTPEO-HTOIPBTDSA-N
Formula
C34H41Cl4N9O9S5
Mass
1021.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
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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
N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls Anisoles Aryl thioethers Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Vinylogous thioesters 1,3-thiazines Tertiary carboxylic acid amides Alpha-halocarboxylic acids Enoate esters Thioenol ethers Secondary carboxylic acid amides Azetidines Carboxylic acid salts Guanidines Dialkylthioethers Carboxylic acids Sulfenyl compounds Carboximidamides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Carbonyl compounds Organochlorides Alkyl chlorides Organic zwitterions Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Phenoxy compound - Aryl thioether - Phenol ether - Methoxybenzene - Anisole - Alkyl aryl ether - Meta-thiazine - Vinylogous thioester - Monocyclic benzene moiety - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Guanidine - Secondary carboxylic acid amide - Thioenolether - Thioether - Azacycle - Hemithioaminal - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboximidamide - Ether - Dialkylthioether - Carboxylic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Alkyl chloride - Alkyl halide - Organic nitrogen compound - Organic zwitterion - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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