Compound Identification
SMILES
CO[C@@H]1C[C@@H](C)O[C@H]2O[C@@H]3C=C4C[C@@H]5O[C@@]55[C@H]([C@H](O)C(=O)[C@@]6(C)[C@H]([C@@H](O)C[C@@]56O)C5=CC(=O)OC5)[C@]4(C)C[C@H]3O[C@]12O
InChIKey
InChIKey=KZONZNOOEZPVDS-YJNPIIESSA-N
Formula
C30H38O12
Mass
590.622
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxepanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxepanes
Alternative Parents
Oxanes Butenolides 1,4-dioxanes Tertiary alcohols Enoate esters Secondary alcohols Lactones Ketones Hemiacetals Cyclic alcohols and derivatives Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Oxepane - Oxane - 2-furanone - Para-dioxane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary alcohol - Dihydrofuran - Cyclic alcohol - Secondary alcohol - Lactone - Ketone - Hemiacetal - Carboxylic acid ester - Oxacycle - Polyol - Monocarboxylic acid or derivatives - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Acetal - 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 oxepanes. These are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms.
External Descriptors
Not available