Compound Identification
SMILES
COC1=C(O)C=C(I)C(CCC(=O)OCC2=C[C@H]3[C@H]4OCO[C@]4(C[C@@H](C)[C@]3(OCC3=CC=CC=C3)[C@@H]3C=C(C)C(=O)[C@@]3(O)C2)C(C)=C)=C1
InChIKey
InChIKey=JLNJBBGGXLAUKY-BJKXORKYSA-N
Formula
C38H43IO9
Mass
770.657
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
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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
Methoxyphenols Benzylethers Phenoxy compounds Anisoles Methoxybenzenes M-iodophenols 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Fatty acid esters Iodobenzenes Aryl iodides 1,3-dioxolanes Tertiary alcohols Carboxylic acid esters Ketones Monocarboxylic acids and derivatives Dialkyl ethers Oxacyclic compounds Acetals Hydrocarbon derivatives Organic oxides Organoiodides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Daphnane diterpenoid - Methoxyphenol - Benzylether - Phenoxy compound - 3-halophenol - Anisole - Methoxybenzene - 3-iodophenol - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Iodobenzene - Halobenzene - Fatty acid ester - Phenol - Aryl halide - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Aryl iodide - Tertiary alcohol - Meta-dioxolane - Carboxylic acid ester - Ketone - Ether - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Acetal - Organohalogen compound - Organic oxygen compound - Carbonyl group - Organoiodide - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Aromatic 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