Compound Identification
SMILES
C[C@@H]1C[C@]2(OC3(CC4=CC=CC=C4)O[C@@H]2[C@@H]2C=C(CNC(=O)CC4=CC=C(NS(C)(=O)=O)C=C4)C[C@@]4(O)[C@@H](C=C(C)C4=O)[C@@]12O3)C(C)=C
InChIKey
InChIKey=VYADWRNTLWPSQB-ARGYEFFCSA-N
Formula
C37H42N2O8S
Mass
674.81
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
Sulfanilides Phenylacetamides 1,3-dioxepanes Carboxylic acid orthoesters Ortho esters 1,3-dioxanes Organic sulfonamides Organosulfonamides Tertiary alcohols Aminosulfonyl compounds 1,3-dioxolanes Ketones Secondary carboxylic acid amides Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Daphnane diterpenoid - Sulfanilide - Phenylacetamide - Ortho ester - 1,3-dioxepane - Carboxylic acid orthoester - Dioxepane - Meta-dioxane - Monocyclic benzene moiety - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Tertiary alcohol - Aminosulfonyl compound - Meta-dioxolane - Carboxamide group - Secondary carboxylic acid amide - Ketone - Orthocarboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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