Compound Identification
SMILES
CNC(=O)CN(CCN(CO)CC(O)=O)C(COC(=O)CCCCCCCOC(=O)OC1CC[C@@]2(C)C(CCC3C4CCC([C@H](C)CCCC(C)C)[C@@]4(C)CCC23)C1)N(CC(O)=O)CC(O)=O
InChIKey
InChIKey=VJLONPBPRRDECB-PQMNICSPSA-N
Formula
C50H86N4O13
Mass
951.253
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Cholestane steroids
- Level 5 Cholesterols and derivatives
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Subclass
Cholestane steroids
-
Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Cholestane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Cholesterols and derivatives
Alternative Parents
Tetracarboxylic acids and derivatives Alpha amino acids and derivatives Carbonic acid diesters Secondary carboxylic acid amides Hemiaminals Carboxylic acid esters Carboxylic acids Aminals Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Cholesterol - Tetracarboxylic acid or derivatives - Alpha-amino acid or derivatives - Carbonic acid diester - Carboxamide group - Carboxylic acid ester - Hemiaminal - Carbonic acid derivative - Secondary carboxylic acid amide - Carboxylic acid - Alkanolamine - Carboxylic acid derivative - Aminal - Organic nitrogen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cholesterols and derivatives. These are compounds containing a 3-hydroxylated cholestane core.
External Descriptors
Not available