Compound Identification
SMILES
CCCCCC=CC=CC12OC3C4C5OC5(CO)C(O)C5(O)C(C(O)=C(C)C5=O)C4(O1)C(C)CC3(O2)C(C)=C
InChIKey
InChIKey=AINRISAKDWHZTN-UHFFFAOYSA-N
Formula
C30H40O9
Mass
544.641
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
- Subclass Diterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Rhamnofolane and daphnane diterpenoids
Alternative Parents
1,3-dioxepanes Carboxylic acid orthoesters Ortho esters 1,3-dioxanes Vinylogous acids Tertiary alcohols 1,3-dioxolanes Secondary alcohols Cyclic alcohols and derivatives Ketones Epoxides Enols Dialkyl ethers Oxacyclic compounds Polyols Primary alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Daphnane diterpenoid - 1,3-dioxepane - Carboxylic acid orthoester - Dioxepane - Ortho ester - Meta-dioxane - Meta-dioxolane - Cyclic alcohol - Vinylogous acid - Tertiary alcohol - Orthocarboxylic acid derivative - Secondary alcohol - Ketone - Polyol - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Enol - Oxirane - Ether - Organic oxide - Organic oxygen compound - Primary alcohol - Alcohol - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as rhamnofolane and daphnane diterpenoids. These are diterpenoids with a structure based on one the rhamnofolane or daphnane skeleton. The rhamnofolane and daphnane skeletons are closely related, being formally derived from casbane by two cyclizations (6,10 and 5,14) followed by cleavage of the 1,15 (daphnane) or 2,15 (rhamnofolane) cyclopropane bonds.
External Descriptors
Not available