Compound Identification
SMILES
O[C@@H](C[C@H](CC1=CC=CC=C1)C(=O)N[C@@H]1[C@H](O)CC2=CC=CC=C12)CN1[C@@H](CC2=CC=C(OCCN3CCOCC3)C=C2)C[C@H](CC2=CC=CC=C2)C1=O
InChIKey
InChIKey=DLCZWAUXSWGRDZ-PAHVIQQXSA-N
Formula
C45H53N3O6
Mass
731.934
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indanes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indanes
Alternative Parents
Phenol ethers Phenoxy compounds Alkyl aryl ethers Morpholines N-acyl amines N-alkylpyrrolidines Pyrrolidine-2-ones Tertiary carboxylic acid amides Amino acids and derivatives Trialkylamines Lactams Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Fatty amide - Morpholine - N-acyl-amine - Oxazinane - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Fatty acyl - Pyrrolidine - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Tertiary aliphatic amine - Amino acid or derivatives - Lactam - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Alcohol - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanes. These are compounds containing an indane moiety, which consists of a cyclopentane fused to a benzene ring.
External Descriptors
Not available