Compound Identification
SMILES
NCCC1=CN(CC2=CC=CC(=C2)C(O)=O)C2=C1C=C(COC1=CC3=CC=CC=C3C=C1)C=C2
InChIKey
InChIKey=IDZJPMCTLKXFQY-UHFFFAOYSA-N
Formula
C29H26N2O3
Mass
450.538
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Tryptamines and derivatives
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Tryptamines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tryptamines and derivatives
Alternative Parents
3-alkylindoles Naphthalenes N-alkylindoles Benzoic acids 2-arylethylamines Phenol ethers Benzoyl derivatives Alkyl aryl ethers Aralkylamines Substituted pyrroles Heteroaromatic compounds Amino acids Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tryptamine - Naphthalene - N-alkylindole - 3-alkylindole - Indole - Benzoic acid or derivatives - Benzoic acid - 2-arylethylamine - Phenol ether - Benzoyl - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxygen compound - Amine - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Primary aliphatic amine - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.
External Descriptors
Not available