Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CCN(CC)CCOC(=O)C(O)(C1=CSC2=CC=CC=C12)C1=CC=CC(C)=C1
InChIKey
InChIKey=JARCMNPYYNHZDS-UHFFFAOYSA-N
Formula
C29H35NO10S
Mass
589.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Tricarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tricarboxylic acids and derivatives
Alternative Parents
1-benzothiophenes Toluenes Thiophenes Tertiary alcohols Heteroaromatic compounds Trialkylamines Carboxylic acid esters Amino acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Not available
Substituents
1-benzothiophene - Tricarboxylic acid or derivatives - Benzothiophene - Toluene - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
External Descriptors
Not available