Compound Identification
SMILES
CC(O)C(=C)C(=O)OC[C@@]12[C@H](CC(C)[C@](C)(CCC3=CC(=O)OC3)[C@H]1[C@H](C[C@H](OC(C)=O)C21CO1)OC(C)=O)OC(C)=O
InChIKey
InChIKey=PIIQPVTUGULYTD-SPWUECPUSA-N
Formula
C31H42O12
Mass
606.665
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
Pentacarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pentacarboxylic acids and derivatives
Alternative Parents
Fatty acid esters Beta hydroxy acids and derivatives Butenolides Enoate esters Secondary alcohols Lactones Oxacyclic compounds Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Fatty acid ester - Beta-hydroxy acid - Fatty acyl - Hydroxy acid - 2-furanone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Dihydrofuran - Secondary alcohol - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pentacarboxylic acids and derivatives. These are carboxylic acids containing exactly five carboxyl groups.
External Descriptors
Not available