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)NCCO
InChIKey
InChIKey=MSXUYJNCHXOPRX-DMCLZXMOSA-N
Formula
C44H71NO16
Mass
870.043
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 Naphthalenecarboxamides Disaccharides O-glycosyl compounds N-acylethanolamines Oxanes Methyl esters Secondary alcohols Secondary carboxylic acid amides Cyclic alcohols and derivatives Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Polyols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - 12-hydroxysteroid - Hydroxysteroid - 12-alpha-hydroxysteroid - Steroid - 2-naphthalenecarboxamide - Disaccharide - Glycosyl compound - O-glycosyl compound - N-acylethanolamine - Oxane - Cyclic alcohol - Methyl ester - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Polyol - Alkanolamine - Carboxylic acid derivative - Acetal - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Organooxygen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Aliphatic 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