Compound Identification
SMILES
[H][C@@]12CC[C@@]3(C)[C@@]([H])(OC(=O)C[C@]3(OC[C@@]3([H])CC(=O)OC(C)(C)[C@]([H])(CC(=O)OC)[C@@]13C)C2=C)C1=COC=C1
InChIKey
InChIKey=ZYHTVDZLLQTOMN-UEJMLVIQSA-N
Formula
C28H36O8
Mass
500.588
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
Oxepanes Delta valerolactones Oxanes Methyl esters Heteroaromatic compounds Furans Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tricarboxylic acid or derivatives - Caprolactone - Delta valerolactone - Delta_valerolactone - Oxepane - Oxane - Heteroaromatic compound - Furan - Methyl ester - Carboxylic acid ester - Lactone - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - 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