Compound Identification
SMILES
CC(=O)OC[C@H]1CC[C@@]2(C)[C@@H](C[C@H](OC(C)=O)[C@@]3(C)OC4=C([C@H](O)[C@H]23)C(=O)OC(=C4)C2=CN=CC=C2)[C@@]1(C)COC(C)=O
InChIKey
InChIKey=NYQIGAQKWWREPH-MQMUQTNESA-N
Formula
C32H39NO10
Mass
597.661
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Hydroxysteroids
- Level 5 1-hydroxysteroids
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Subclass
Hydroxysteroids
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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
Hydroxysteroids
Intermediate Tree Nodes
Not available
Direct Parent
1-hydroxysteroids
Alternative Parents
Terpene lactones Sesquiterpenoids Naphthopyrans Naphthalenes Tricarboxylic acids and derivatives Pyranones and derivatives Alkyl aryl ethers Pyridines and derivatives Vinylogous esters Heteroaromatic compounds Secondary alcohols Lactones Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-hydroxysteroid - Terpene lactone - Sesquiterpenoid - Naphthopyran - Naphthalene - Tricarboxylic acid or derivatives - Pyranone - Alkyl aryl ether - Pyridine - Pyran - Heteroaromatic compound - Vinylogous ester - Secondary alcohol - Lactone - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-hydroxysteroids. These are steroids carrying a hydroxyl group at the 1-position of the steroid backbone.
External Descriptors
Not available