Compound Identification
SMILES
CC(=C)[C@@H]1N2C3=C(C1=O)C1=C(C=C3C3=C2[C@@]2(C)C(C3)CC[C@@H]3[C@]2(C)CC[C@H](O)[C@@]3(C)\C=C\CC(=O)NCC2=CC=CO2)C2=CC(C)(C)OC(C)(C)C2[C@@H]1O
InChIKey
InChIKey=KHDRUYNKMGWMPD-XMMDXHCMSA-N
Formula
C46H56N2O6
Mass
732.962
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
Indanes Aryl alkyl ketones Pyrrolizines N-acyl amines Pyrans Vinylogous amides Furans Heteroaromatic compounds Pyrroles Secondary alcohols Secondary carboxylic acid amides Cyclic alcohols and derivatives Azacyclic compounds Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Indane - Pyrrolizine - Aryl ketone - Aryl alkyl ketone - N-acyl-amine - Pyran - Benzenoid - Cyclic alcohol - Furan - Pyrrole - Heteroaromatic compound - Vinylogous amide - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Ketone - Carboxylic acid derivative - Azacycle - Oxacycle - Dialkyl ether - Ether - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organopnictogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available