Compound Identification
SMILES
COC(=O)NC(C(=O)NN(CC(O)C(CC1=CC=C(OCCNS(C)(=O)=O)C=C1)NC(=O)OC1COC2OCCC12)CC1=CC=C(C=C1)C1=CC=CC=N1)C(C)(C)C
InChIKey
InChIKey=DINLPRPVLRKUSH-UHFFFAOYSA-N
Formula
C40H54N6O11S
Mass
826.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
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Level 6
Alpha amino acids and derivatives
-
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
Valine and derivatives
Alternative Parents
Phenylpyridines Phenylbutylamines Amphetamines and derivatives Furofurans Phenol ethers Phenoxy compounds Alkyl aryl ethers Organosulfonamides Organic sulfonamides Aminosulfonyl compounds Methylcarbamates Heteroaromatic compounds Oxolanes Secondary alcohols Carboxylic acid hydrazides Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - 2-phenylpyridine - Phenylbutylamine - Amphetamine or derivatives - Phenoxy compound - Furofuran - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Methylcarbamate - Oxolane - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Carbamic acid ester - Aminosulfonyl compound - Carboxylic acid hydrazide - Secondary alcohol - Oxacycle - Acetal - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Alcohol - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available