Compound Identification
SMILES
C[C@@H]([C@H]1CC[C@H]2[C@@H]3CCC4=CC(CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)C(=O)OC[C@H]1O[C@H](C[C@@H]1N=[N+]=[N-])N1C=C(C)C(=O)NC1=O
InChIKey
InChIKey=IUKNXPWYHREVAW-RPLTWALYSA-N
Formula
C34H47N5O7
Mass
637.778
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Bile acids, alcohols and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Bile acids, alcohols and derivatives
Alternative Parents
Steroid esters Delta-4-steroids Pyrimidine 2',3'-dideoxyribonucleosides Pyrimidones Dicarboxylic acids and derivatives Hydropyrimidines Tetrahydrofurans Vinylogous amides Heteroaromatic compounds Ureas Azo compounds Azo imides Carboxylic acid esters Lactams Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bile acid, alcohol, or derivatives - Steroid ester - Delta-4-steroid - Pyrimidine 2',3'-dideoxyribonucleoside - Pyrimidine nucleoside - Pyrimidone - Dicarboxylic acid or derivatives - Hydropyrimidine - Pyrimidine - Vinylogous amide - Tetrahydrofuran - Heteroaromatic compound - Urea - Azo imide - Carboxylic acid ester - Azo compound - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic zwitterion - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bile acids, alcohols and derivatives. These are organic compounds containing an alcohol or acid derivative of cholic acid.
External Descriptors
Not available