Compound Identification
SMILES
OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@H](O)[C@H](OC(=O)CC3=CNC4=CC=CC=C34)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
InChIKey
InChIKey=VHFRZSJSHFOBOM-BBHIQVKASA-N
Formula
C22H29NO12
Mass
499.469
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
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Subclass
Indolyl carboxylic acids and derivatives
- Level 5 Indole-3-acetic acid derivatives
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Subclass
Indolyl carboxylic acids and derivatives
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indole-3-acetic acid derivatives
Alternative Parents
Hexoses O-glycosyl compounds 3-alkylindoles Cyclohexanols Substituted pyrroles Oxanes Benzenoids Cyclitols and derivatives Heteroaromatic compounds Carboxylic acid esters Polyols Oxacyclic compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - 3-alkylindole - Indole - Cyclohexanol - Cyclitol or derivatives - Monosaccharide - Oxane - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Azacycle - Polyol - Acetal - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Primary alcohol - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.
External Descriptors
Not available