Compound Identification
SMILES
CC(C)C1=CC2CC3(C=O)[C@@H]4CC[C@@H](C)[C@H]4CC2(CO[C@@H]2O[C@H](C)CN(CC4=CC=CS4)C[C@@H]2O)[C@]13C(O)=O
InChIKey
InChIKey=XKOJSNSYYZNIBO-NRBWTFABSA-N
Formula
C31H43NO6S
Mass
557.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Sesquiterpenoids
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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
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Sesquiterpenoids
Alternative Parents
1,4-oxazepines Aralkylamines Thiophenes Heteroaromatic compounds 1,2-aminoalcohols Trialkylamines Amino acids Secondary alcohols Oxacyclic compounds Carboxylic acids Azacyclic compounds Acetals Monocarboxylic acids and derivatives Aldehydes Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Sesquiterpenoid - Para-oxazepine - Aralkylamine - Heteroaromatic compound - Thiophene - 1,2-aminoalcohol - Amino acid or derivatives - Secondary alcohol - Amino acid - Tertiary amine - Tertiary aliphatic amine - Acetal - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Alcohol - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aldehyde - Amine - Organopnictogen compound - Aromatic 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