Compound Identification
SMILES
CCCCCCN(CCOC1=CC=C(CCCCN=C(N)NC(=O)C2=C(N)N=C(N)C(Cl)=N2)C=C1)C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO
InChIKey
InChIKey=HBZAZSCNDMDWEU-NJRQHTIISA-N
Formula
C30H49ClN8O7
Mass
669.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Pyrazinecarboxamides Phenoxy compounds Phenol ethers Alkyl aryl ethers Aminopyrazines Aryl chlorides Monosaccharides Imidolactams Vinylogous amides 1,3-aminoalcohols Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Guanidines Propargyl-type 1,3-dipolar organic compounds Polyols Azacyclic compounds Carboximidamides Organochlorides Organic oxides Primary alcohols Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyrazine - Aryl chloride - Pyrazine - Imidolactam - Aryl halide - Monosaccharide - 1,3-aminoalcohol - Heteroaromatic compound - Vinylogous amide - Secondary alcohol - Amino acid or derivatives - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Guanidine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Polyol - Hydrocarbon derivative - Amine - Organic oxide - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Primary alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available