Compound Identification
SMILES
CN1CCN2N=C(NC3CC(NNC3=O)C3=C(CO)C(=CC=C3)N3CC4=C(SC(=C4)C(C)(C)C)C3=O)C=C2C1
InChIKey
InChIKey=XVVZNBJRUQSYCQ-UHFFFAOYSA-N
Formula
C28H35N7O3S
Mass
549.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
Class
Carboxylic acids and derivatives
-
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
2,3,5-trisubstituted thiophenes 2-heteroaryl carboxamides Benzyl alcohols Aralkylamines Imidolactams Diazinanes Tertiary carboxylic acid amides Pyrazoles Heteroaromatic compounds Trialkylamines Lactams Carboxylic acid hydrazides Azacyclic compounds Primary alcohols Aromatic alcohols Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - 2-heteroaryl carboxamide - Benzyl alcohol - 2,3,5-trisubstituted thiophene - Aralkylamine - Monocyclic benzene moiety - 1,2-diazinane - Imidolactam - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Tertiary carboxylic acid amide - Thiophene - Carboxamide group - Carboxylic acid hydrazide - Lactam - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary alcohol - Aromatic alcohol - Organic oxygen 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