Compound Identification
SMILES
CC1=CC(=O)[C@@H](O)[C@@]2(C)[C@H]1C[C@@H](O)[C@@]13CO[C@@]4(C)[C@@H]1C[C@H](O)C(=O)O[C@H]4[C@H](O)[C@H]23
InChIKey
InChIKey=JQRXDXNJURQDRN-JBAAVECLSA-N
Formula
C21H28O8
Mass
408.447
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Lactones
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Lactones
Alternative Parents
Oxepanes Cyclohexenones Tetrahydrofurans Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Caprolactone - Cyclohexenone - Oxepane - Cyclic alcohol - Tetrahydrofuran - Carboxylic acid ester - Ketone - Lactone - Secondary alcohol - Cyclic ketone - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Polyol - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Organic oxide - Alcohol - Hydrocarbon derivative - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lactones. These are cyclic esters of hydroxy carboxylic acids, containing a 1-oxacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring.
External Descriptors
Not available