Compound Identification
SMILES
CC(C)=C[C@H]1C[C@](C)(O)[C@@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@@H](COC(=O)CC(O)=O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@@]33CO[C@@]2(C3)O1
InChIKey
InChIKey=JFGJFDHXXKGFOP-PFZJDLLKSA-N
Formula
C49H76O20
Mass
985.127
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
Steroids and steroid derivatives Naphthopyrans Disaccharides O-glycosyl compounds Naphthalenes Ketals Dicarboxylic acids and derivatives Pyrans 1,3-dicarbonyl compounds Oxanes Tetrahydrofurans Tertiary alcohols Secondary alcohols Carboxylic acid esters Carboxylic acids Oxacyclic compounds Polyols Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Steroid - Naphthopyran - Disaccharide - Glycosyl compound - O-glycosyl compound - Naphthalene - Ketal - Dicarboxylic acid or derivatives - Oxane - Pyran - 1,3-dicarbonyl compound - Tetrahydrofuran - Tertiary alcohol - Secondary alcohol - Carboxylic acid ester - Polyol - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Acetal - Primary alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Carbonyl group - 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