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=WLIXAOOKUXRJKK-YNDZBNFHSA-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 Aryl alkyl ketones Pyrrolizines Fatty acid esters Pyrans Methyl esters Pyrroles Heteroaromatic compounds Enoate esters Vinylogous amides Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Indane - Pyrrolizine - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Pyran - Benzenoid - Fatty acyl - Cyclic alcohol - Pyrrole - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Vinylogous amide - Secondary alcohol - Carboxylic acid ester - Ketone - Dialkyl ether - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organopnictogen compound - Alcohol - Organic oxide - 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