Compound Identification
SMILES
[H]C(O)(CC)C1(C)CC([H])(C)C([H])(O1)C1([H])CC([H])(C)C([H])(O1)C1(C)OC([H])(CC1([H])OC)C1(C)OC2(CC1([H])C)CC([H])(O)C([H])(C)C([H])(CC([H])(OC(=O)C1=C(O)C=C(OC)C=C1C)C(C)(O)C(O)=O)O2
InChIKey
InChIKey=SGLQOFJJLQBZBE-UHFFFAOYSA-N
Formula
C45H70O15
Mass
851.04
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
Methoxybenzoic acids and derivatives
Direct Parent
P-methoxybenzoic acids and derivatives
Alternative Parents
o-Hydroxybenzoic acid esters Salicylic acid and derivatives Methoxyphenols Phenoxy compounds Anisoles Benzoyl derivatives Methoxybenzenes Meta cresols 1-hydroxy-2-unsubstituted benzenoids Toluenes 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Ketals Alpha hydroxy acids and derivatives Oxanes Dicarboxylic acids and derivatives Vinylogous acids Tertiary alcohols Oxolanes Carboxylic acid esters Secondary alcohols Oxacyclic compounds Carboxylic acids Dialkyl ethers Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-hydroxybenzoic acid ester - P-methoxybenzoic acid or derivatives - Methoxyphenol - Salicylic acid or derivatives - Benzoate ester - Phenoxy compound - Phenol ether - M-cresol - Benzoyl - Methoxybenzene - Anisole - Toluene - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Ketal - Dicarboxylic acid or derivatives - Hydroxy acid - Oxane - Alpha-hydroxy acid - Vinylogous acid - Tertiary alcohol - Oxolane - Carboxylic acid ester - Secondary alcohol - Ether - Acetal - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 4 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available