Compound Identification
SMILES
COC(=O)NC1C(=O)C(O[C@H]2C[C@H](OC(=O)C3=CC(OC)=C(OC)C=C3NC(=O)C(=C)OC)[C@H](O)[C@H](C)O2)C2(O)C3=CCSC13C(O)C1=CC=CC=C21
InChIKey
InChIKey=VJHJKMGVGQWRIC-WOOBKUMDSA-N
Formula
C36H40N2O14S
Mass
756.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Hexoses P-methoxybenzoic acids and derivatives O-glycosyl compounds M-methoxybenzoic acids and derivatives Tetralins Dimethoxybenzenes Benzoic acid esters Methoxyanilines Anilides Phenoxy compounds N-arylamides Benzoyl derivatives Anisoles Alkyl aryl ethers Oxanes Vinylogous amides Tertiary alcohols Methylcarbamates Dihydrothiophenes Secondary carboxylic acid amides Secondary alcohols Organic carbonic acids and derivatives Cyclic ketones Cyclic alcohols and derivatives Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Hexose monosaccharide - P-methoxybenzoic acid or derivatives - O-glycosyl compound - M-methoxybenzoic acid or derivatives - Glycosyl compound - O-dimethoxybenzene - Dimethoxybenzene - Tetralin - Benzoate ester - Methoxyaniline - Anilide - Phenoxy compound - Methoxybenzene - N-arylamide - Phenol ether - Benzoyl - Anisole - Alkyl aryl ether - Oxane - Monosaccharide - Methylcarbamate - Vinylogous amide - Carbamic acid ester - Tertiary alcohol - 2,5-dihydrothiophene - Cyclic alcohol - Cyclic ketone - Secondary carboxylic acid amide - Secondary alcohol - Carbonic acid derivative - Ketone - Carboxylic acid ester - Carboxamide group - Oxacycle - Organoheterocyclic compound - Dialkylthioether - Thioether - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available