Compound Identification
SMILES
CO\N=C1\[C@H]2SC(NC(=O)CC3=CSC(N)=N3)C(CSC3NNC(=O)C(=O)N3C)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=XMMBZSQLTGQGFG-UXPLIBAMSA-N
Formula
C18H20N8O7S3
Mass
556.59
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Cephems 2,4-disubstituted thiazoles 1,2,4-triazinanes 1,2,4-triazines 1,3-thiazines 2-amino-1,3-thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds N,S-acetals Carboxylic acid hydrazides Azetidines Amino acids Oxime ethers Secondary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Cephem - 2,4-disubstituted 1,3-thiazole - 1,2,4-triazinane - Meta-thiazine - Triazinane - Triazine - 1,3-thiazol-2-amine - 1,2,4-triazine - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Beta-lactam - Azole - N,s-acetal - Carboxylic acid hydrazide - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Oxime ether - Lactam - Amino acid - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Carboxylic acid - Thioether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic nitrogen compound - Primary amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available