Compound Identification
SMILES
CCCCOC1=CC=C(CC2=NN(CC)C(=C2)C2CCN(C[C@H]3CN(C[C@@H]3C3=CC(F)=CC=C3)[C@@H](C(O)=O)C(C)(C)C)CC2)C=C1
InChIKey
InChIKey=MRFRACBBILXIMQ-JYIZODLMSA-N
Formula
C38H53FN4O3
Mass
632.865
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
-
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
Phenylpyrrolidines D-alpha-amino acids Phenoxy compounds Phenol ethers Alkyl aryl ethers Aralkylamines Fluorobenzenes Piperidines N-alkylpyrrolidines Aryl fluorides Pyrroles Pyrazoles Heteroaromatic compounds Trialkylamines Amino acids Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organofluorides Organopnictogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Valine or derivatives - 3-phenylpyrrolidine - Alpha-amino acid - D-alpha-amino acid - Phenol ether - Phenoxy compound - Halobenzene - Alkyl aryl ether - Fluorobenzene - Aralkylamine - Monocyclic benzene moiety - Piperidine - Aryl fluoride - Benzenoid - N-alkylpyrrolidine - Aryl halide - Pyrrolidine - Pyrrole - Pyrazole - Heteroaromatic compound - Azole - Tertiary aliphatic amine - Tertiary amine - Amino acid - Azacycle - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organopnictogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic 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