Compound Identification
SMILES
N\C(=N/N=CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(=NO)C1=CSC(N)=N1)C2=O)C(O)=O)N1CCNCC1
InChIKey
InChIKey=UXWYCYYLFCIYIF-IAQYHMDHSA-N
Formula
C18H22N10O5S2
Mass
522.56
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
N-acyl-alpha amino acids and derivatives 2,4-disubstituted thiazoles 1,3-thiazines 2-amino-1,3-thiazoles Piperazines Tertiary carboxylic acid amides Heteroaromatic compounds Ketoximes Secondary carboxylic acid amides Amino acids Azetidines Guanidines Dialkylthioethers Dialkylamines Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Carbonyl compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - Piperazine - 1,4-diazinane - 1,3-thiazol-2-amine - Ketoxime - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Azole - Secondary carboxylic acid amide - Amino acid or derivatives - Guanidine - Azetidine - Carboxamide group - Amino acid - Azacycle - Dialkylthioether - Hemithioaminal - Carboxylic acid derivative - Carboxylic acid - Thioether - Secondary aliphatic amine - Secondary amine - Monocarboxylic acid or derivatives - Organic oxide - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Primary amine - Carbonyl group - Organooxygen compound - Organonitrogen 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