Compound Identification
SMILES
CO[C@]1(NC(=O)CCCC(N)C(O)=O)[C@@H]2SCC(CSC(N)=[NH2+])=C(N2C1=O)C(O)=O
InChIKey
InChIKey=NBFTTWYIDHGZSB-OLQAXGSLSA-O
Formula
C16H24N5O7S2
Mass
462.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
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Level 6
Cephalosporins
- Level 7 Cephamycins
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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 - Cephalosporins
Direct Parent
Cephamycins
Alternative Parents
N-acyl-alpha amino acids and derivatives Alpha amino acids Medium-chain fatty acids Heterocyclic fatty acids Dicarboxylic acids and derivatives N-acyl amines 1,3-thiazines Tertiary carboxylic acid amides Amino acids Azetidines Secondary carboxylic acid amides Carboximidamides Azacyclic compounds Thiohemiaminal derivatives Dialkylthioethers Sulfenyl compounds Carboxylic acids Organic oxides Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cephamycin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Medium-chain fatty acid - Heterocyclic fatty acid - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Meta-thiazine - N-acyl-amine - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Amino acid - Secondary carboxylic acid amide - Azetidine - Azacycle - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Carboximidamide - Hemithioaminal - Thioether - Amine - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Primary aliphatic amine - Carbonyl group - Primary amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic cation - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephamycins. These are compounds containing a the cephalosporin (oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid) nucleus, with an alkyloxy group attached to the C6 carbon atom.
External Descriptors
Not available