Compound Identification
SMILES
[H][C@@](C)(C=CCC(C)C)C=CC=C(C)[C@@]1([H])[C@@]([H])(O)C=C(CN2CCS(=O)(=O)C[C@]3([H])C(=O)[C@]([H])(O)[C@@]([H])(C(C)=CC=C[C@@]([H])(C)C=CCC(C)C)[C@@]([H])(OC(C)=O)[C@@]23[H])C(=O)[C@]1([H])O
InChIKey
InChIKey=WDGHVYJKVQZOLD-WLXWSNMASA-N
Formula
C44H65NO9S
Mass
784.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Sesquiterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Sesquiterpenoids
Alternative Parents
Cyclohexenones Sulfones Trialkylamines Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Sesquiterpenoid - Bisabolane sesquiterpenoid - Cyclohexenone - Cyclic alcohol - Sulfone - Amino acid or derivatives - Carboxylic acid ester - Ketone - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organopnictogen compound - Organic oxygen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.
External Descriptors
Not available