Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=C(OCCCNC(C)=O)C=C1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=GBNBWDWUMKXXKY-OLNQLETPSA-N
Formula
C33H45N3O11S
Mass
691.79
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
Amphetamines and derivatives Benzodioxoles Phenoxy compounds Phenol ethers Furofurans Alkyl aryl ethers Organosulfonamides Acetamides Aminosulfonyl compounds Oxolanes Carbamate esters Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Benzodioxole - Phenoxy compound - Furofuran - Phenol ether - Alkyl aryl ether - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Oxolane - Acetamide - Aminosulfonyl compound - Carbamic acid ester - Sulfonyl - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Acetal - Carboxylic acid derivative - Ether - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organic oxide - Carbonyl group - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic 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