Compound Identification
SMILES
CCC(=O)CCC(C)(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OC1COC2OCCC12)S(=O)(=O)C1=CC=C(OC)C=C1
InChIKey
InChIKey=FFHINWSZXFYTBM-ZXNBJGMGSA-N
Formula
C33H46N2O9S
Mass
646.8
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 Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Methoxybenzenes Furofurans Anisoles Alkyl aryl ethers Organosulfonamides Oxolanes Aminosulfonyl compounds Carbamate esters Secondary alcohols Ketones Oxacyclic compounds Acetals Hydrocarbon derivatives Organic oxides Organonitrogen compounds Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Anisole - Furofuran - Phenol ether - Methoxybenzene - Alkyl aryl ether - Organosulfonic acid amide - Oxolane - Organic sulfonic acid or derivatives - Carbamic acid ester - Sulfonyl - Aminosulfonyl compound - Organosulfonic acid or derivatives - Secondary alcohol - Ketone - Acetal - Ether - Oxacycle - Organoheterocyclic compound - Aldehyde - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen 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