Compound Identification
SMILES
COC1=C(C)C(C)=C(C(C)=C1)S(=O)(=O)NC(N)=NCCC[C@H](NC(=O)[C@H](CC1=CN(CC2=CC=CC=C2)C=N1)NC(=O)OC(C)(C)C)C(O)C1=NC=CS1
InChIKey
InChIKey=NLIDNFFSKAFONT-MYABOAQRSA-N
Formula
C37H50N8O7S2
Mass
782.98
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
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Histidine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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 - Alpha amino acids and derivatives
Direct Parent
Histidine and derivatives
Alternative Parents
Alpha amino acid amides Benzenesulfonamides Benzenesulfonyl compounds Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fatty amides N-substituted imidazoles Thiazoles Aminosulfonyl compounds Organosulfonic acids and derivatives Carbamate esters Heteroaromatic compounds Secondary alcohols Secondary carboxylic acid amides Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Carbonyl compounds Organic oxides Aromatic alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Histidine or derivatives - Alpha-amino acid amide - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Fatty amide - N-substituted imidazole - Benzenoid - Fatty acyl - Imidazole - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiazole - Carbamic acid ester - Aminosulfonyl compound - Secondary carboxylic acid amide - Carboxamide group - Guanidine - Secondary alcohol - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Ether - Organoheterocyclic compound - Carboximidamide - Azacycle - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as histidine and derivatives. These are compounds containing cysteine or a derivative thereof resulting from reaction of cysteine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available