Compound Identification
SMILES
C[C@@H](C1CCC2C3C4OC4[C@@]4(CCC(=O)O4)[C@@H](C)C3=CC(=O)[C@]12C)[C@H]1C[C@]2(C)O[C@](C)(OC2(C)C)O1
InChIKey
InChIKey=COCPASNZXWPLFW-VIUOZNQPSA-N
Formula
C29H40O7
Mass
500.632
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Dioxepanes
- Subclass 1,3-dioxepanes
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Class
Dioxepanes
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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
Carboxylic acid orthoesters Cyclohexenones Ortho esters Oxepanes Gamma butyrolactones 1,3-dioxanes 1,3-dioxolanes Oxolanes Carboxylic acid esters Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
1,3-dioxepane - Cyclohexenone - Carboxylic acid orthoester - Oxepane - Ortho ester - Meta-dioxane - Gamma butyrolactone - Meta-dioxolane - Oxolane - Carboxylic acid ester - Orthocarboxylic acid derivative - Ketone - Lactone - Ether - Oxirane - Dialkyl ether - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aldehyde - 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