Compound Identification
SMILES
COC(=O)C\C=C\[C@]1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CCC1CC3=C(N4[C@@H](C(C)=C)C(=O)C5=C4C3=CC3=C5[C@@H](O)C4C3=CC(C)(C)OC4(C)C)[C@]21C
InChIKey
InChIKey=IQUYXMGSQWKEPZ-IKIHMEDTSA-N
Formula
C42H53NO6
Mass
667.887
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 Pyrrolizines Aryl alkyl ketones Fatty acid methyl esters Pyrans Vinylogous amides Pyrroles Heteroaromatic compounds Methyl esters Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Indane - Pyrrolizine - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Fatty acid methyl ester - Pyran - Benzenoid - Fatty acyl - Vinylogous amide - Heteroaromatic compound - Cyclic alcohol - Methyl ester - Pyrrole - Carboxylic acid ester - Ketone - Secondary alcohol - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Alcohol - Organopnictogen compound - 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