Compound Identification
SMILES
COCC1=C2B(O)O[C@@H](C[C@H]2[C@@H]2[C@H](C1)C(=O)N(CCCCCC(O)=O)C2=O)C1=CC(C)=C(O)C(C)=C1
InChIKey
InChIKey=MRXZJSDUDSKBTR-BPBCIEFSSA-N
Formula
C26H34BNO8
Mass
499.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- 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
Indolyl carboxylic acids and derivatives
Alternative Parents
Isoindolones Indoles Isoindoles m-Xylenes Medium-chain fatty acids Ortho cresols Hydroxy fatty acids N-substituted carboxylic acid imides N-alkylpyrrolidines Pyrrolidine-2-ones Oxaborine derivatives Boronic acid esters Dicarboximides Lactams Carboxylic acids Organic metalloid salts Monocarboxylic acids and derivatives Dialkyl ethers Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organometalloid compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolyl carboxylic acid derivative - Isoindolone - Isoindole or derivatives - Isoindole - Isoindoline - Indole - M-xylene - Xylene - O-cresol - Medium-chain fatty acid - Phenol - Hydroxy fatty acid - Benzenoid - N-alkylpyrrolidine - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - 1,2-oxaborine derivative - Monocyclic benzene moiety - Fatty acyl - Pyrrolidine - Boronic acid ester - Carboxylic acid imide - Dicarboximide - Boronic acid derivative - Lactam - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Oxacycle - Ether - Azacycle - Organic metalloid salt - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. These are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring.
External Descriptors
Not available