Compound Identification
SMILES
CC(C)(C)C(=O)OCOC(=O)C1=C(CSC2C(NC(=O)C(\N=O)=C3\NSC(N)=N3)C(=O)N12)\C=C/C1=CSN=N1
InChIKey
InChIKey=ATTYAQPYULUHHV-UETZTNTPSA-N
Formula
C21H22N8O7S3
Mass
594.64
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
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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 Alpha amino acid amides Acylals 1,3-thiazines Dicarboxylic acids and derivatives Vinylogous amides Thiadiazolines Thiadiazoles Tertiary carboxylic acid amides Enoate esters Heteroaromatic compounds Secondary carboxylic acid amides Azetidines Dialkylthioethers Carboximidamides C-nitroso compounds Acetals Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Thiohemiaminal derivatives Organopnictogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Acylal - Meta-thiazine - Dicarboxylic acid or derivatives - Azole - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Thiadiazole - Thiadiazoline - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Azetidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carboximidamide - Hemithioaminal - Thioether - Propargyl-type 1,3-dipolar organic compound - Organic nitroso compound - C-nitroso compound - Acetal - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Dialkylthioether - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen 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