Compound Identification
SMILES
COC(=O)[C@@H](CCSC)NC(=O)[C@]12CC[C@@](C)(C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@H](O)[C@H](O[C@@H]5OC[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@@](C)(CO)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=O)OC
InChIKey
InChIKey=ASNJAJALONSWCL-CKPMOYPOSA-N
Formula
C48H77NO17S
Mass
972.19
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 Methionine and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Naphthalenecarboxamides Disaccharides O-glycosyl compounds Fatty acid esters Dicarboxylic acids and derivatives Oxanes Methyl esters Secondary alcohols Cyclic alcohols and derivatives Secondary carboxylic acid amides Oxacyclic compounds Acetals Polyols Sulfenyl compounds Dialkylthioethers Organopnictogen compounds Hydrocarbon derivatives Primary alcohols Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Hydroxysteroid - 12-hydroxysteroid - 12-alpha-hydroxysteroid - Steroid - Methionine or derivatives - Alpha-amino acid ester - 2-naphthalenecarboxamide - N-acyl-alpha amino acid or derivatives - O-glycosyl compound - Disaccharide - Glycosyl compound - Alpha-amino acid or derivatives - Fatty acid ester - Oxane - Dicarboxylic acid or derivatives - Fatty acyl - Cyclic alcohol - Methyl ester - Secondary alcohol - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Polyol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Primary alcohol - Alcohol - Organosulfur compound - Organooxygen compound - 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