Compound Identification
SMILES
COC(=O)[C@@]1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6OC[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)ON1N=NC2=CC=CC=C12
InChIKey
InChIKey=DIXJDTVJVLYROU-PEFFOWBFSA-N
Formula
C48H69N3O16
Mass
944.085
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Triterpenoids
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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
Triterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Triterpenoids
Alternative Parents
12-alpha-hydroxysteroids Disaccharides O-glycosyl compounds Benzotriazoles Benzenoids Oxanes Dicarboxylic acids and derivatives Triazoles Heteroaromatic compounds Methyl esters Secondary alcohols Carboxylic acid salts Cyclic alcohols and derivatives Oxacyclic compounds Azacyclic compounds Acetals Polyols Organonitrogen compounds Organopnictogen compounds Carbonyl compounds Primary alcohols Hydrocarbon derivatives Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triterpenoid - 12-hydroxysteroid - Hydroxysteroid - 12-alpha-hydroxysteroid - Steroid - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzotriazole - Dicarboxylic acid or derivatives - Oxane - Benzenoid - Azole - Cyclic alcohol - Heteroaromatic compound - Triazole - 1,2,3-triazole - Methyl ester - Secondary alcohol - Carboxylic acid ester - Carboxylic acid salt - Acetal - Organoheterocyclic compound - Carboxylic acid derivative - Polyol - Azacycle - Oxacycle - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic salt - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
External Descriptors
Not available