Compound Identification
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CNCCC1=C(NC2=CC=CC=C12)C1[C@@H]2[C@H](C=C(C)CC2(C)C)[C@]23NC4=CC=CC=C4[C@]12CCN3C
InChIKey
InChIKey=WSRYWHXHFRAUAW-IGBPSIRZSA-N
Formula
C36H46N4O6
Mass
630.786
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Pyrroloindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyrroloindoles
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloindoles
Alternative Parents
Tryptamines and derivatives 2,3-Cyclopentanoindolines 3-alkylindoles Sugar acids and derivatives Short-chain hydroxy acids and derivatives Aralkylamines Beta hydroxy acids and derivatives Substituted pyrroles Alpha hydroxy acids and derivatives Benzenoids N-alkylpyrrolidines Dicarboxylic acids and derivatives Fatty acids and conjugates Monosaccharides Heteroaromatic compounds 1,2-diols Secondary alcohols Carboxylic acids Dialkylamines Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Pyrroloindole - Tryptamine - 2,3-cyclopentanoindoline - 3-alkylindole - Dihydroindole - Indole - Beta-hydroxy acid - Short-chain hydroxy acid - Aralkylamine - Sugar acid - Monosaccharide - Dicarboxylic acid or derivatives - Fatty acid - Substituted pyrrole - Benzenoid - Alpha-hydroxy acid - N-alkylpyrrolidine - Hydroxy acid - Pyrrolidine - Heteroaromatic compound - Pyrrole - 1,2-diol - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Secondary amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Alcohol - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloindoles. These are compounds containing a pyrroloindole moiety, which is a tricyclic heterocycle which consists of a pyrrole ring fused to an indole. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Indole is a bicyclic compound consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available