Compound Identification
SMILES
CC[C@H](C)C[C@H](C)\C=C\C(=O)O[C@@H]1[C@@H](O)C2(CCC(=C)[C@@H](OC(C)=O)[C@H](C)CC3=CC=CC=C3)OC1(C(O)=O)C(O)(C(O2)C(=O)NCCOC)C(=O)OCOC(=O)C(C)(C)C
InChIKey
InChIKey=PCSABQQMYMOOLO-KVNMNTJDSA-N
Formula
C44H63NO16
Mass
861.979
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
Phenylpropanes Acylals Fatty acid esters Ketals Oxepanes 1,3-dioxanes Monosaccharides Tetrahydrofurans Tertiary alcohols Enoate esters Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Dialkyl ethers Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Phenylpropane - Oxepane - Acylal - Fatty acid ester - Ketal - Monosaccharide - Monocyclic benzene moiety - Fatty acyl - Meta-dioxane - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Tertiary alcohol - Secondary alcohol - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Acetal - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Alcohol - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aromatic 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