Compound Identification
SMILES
COCCOCC#CB(C#CCOCCOC)N1C(C)=CC(C)=C1\C(=C1/N=C(C)C=C1C)C1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=NJNZSXDFYXELIH-FLWNBWAVSA-N
Formula
C32H37BN2O6
Mass
556.47
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acids
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acids
Alternative Parents
Benzoyl derivatives Substituted pyrroles Heteroaromatic compounds Ketimines Propargyl-type 1,3-dipolar organic compounds Organic metalloid salts Dialkyl ethers Carboxylic acids Azacyclic compounds Organometalloid compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid - Benzoyl - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Ketimine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic metalloid salt - Organic metalloid moeity - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Imine - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available