Compound Identification
SMILES
CC(C1CCC2C3C4OC4C4(CCC(=O)O4)C(C)C3=CCC12C)C1CC2(C)OC(C)(OC2(C)C)O1
InChIKey
InChIKey=TYYKVPXPTUCZNL-UHFFFAOYSA-N
Formula
C29H42O6
Mass
486.649
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Dioxepanes
- Subclass 1,3-dioxepanes
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Class
Dioxepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dioxepanes
Subclass
1,3-dioxepanes
Intermediate Tree Nodes
Not available
Direct Parent
1,3-dioxepanes
Alternative Parents
Oxepanes Ortho esters Carboxylic acid orthoesters Gamma butyrolactones 1,3-dioxanes Tetrahydrofurans 1,3-dioxolanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
1,3-dioxepane - Carboxylic acid orthoester - Oxepane - Ortho ester - Meta-dioxane - Gamma butyrolactone - Meta-dioxolane - Tetrahydrofuran - Carboxylic acid ester - Orthocarboxylic acid derivative - Lactone - Ether - Oxirane - Dialkyl ether - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-dioxepanes. These are dioxepanes with the two ring oxygen atoms at position 1 and 3, respectively.
External Descriptors
Not available