Compound Identification
SMILES
COC1=CC2=C(SCC(=O)OCC(=O)[C@@]3(O)CC[C@H]4[C@@H]5CCC6=CC(=O)C=C[C@]6(C)[C@H]5C(=O)C[C@]34C)C3=C(C=C(Cl)C=C3)N=C2C=C1
InChIKey
InChIKey=KRTGJHNXSFHDST-MIVFOVIQSA-N
Formula
C37H36ClNO7S
Mass
674.21
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Oxosteroids
- Level 5 20-oxosteroids
-
Subclass
Oxosteroids
-
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
Oxosteroids
Intermediate Tree Nodes
Not available
Direct Parent
20-oxosteroids
Alternative Parents
Androgens and derivatives 3-oxo delta-1,4-steroids 17-hydroxysteroids 11-oxosteroids Delta-1,4-steroids Diterpenoids Acridines Haloquinolines Anisoles Methylpyridines Hydroxypyridines Alpha-acyloxy ketones Alkylarylthioethers Alkyl aryl ethers Monosaccharides Acyloins Tertiary alcohols Secondary ketimines Heteroaromatic compounds Enones Alpha-hydroxy ketones Acryloyl compounds Thioenol ethers Cyclic ketones Cyclic alcohols and derivatives Carboxylic acid esters Vinyl chlorides Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Chloroalkenes Azacyclic compounds Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
20-oxosteroid - Diterpenoid - Androgen-skeleton - Androstane-skeleton - 17-hydroxysteroid - 11-oxosteroid - Hydroxysteroid - 3-oxosteroid - 3-oxo-delta-1,4-steroid - Delta-1,4-steroid - Benzoquinoline - Acridine - Haloquinoline - Quinoline - Aryl thioether - Anisole - Methylpyridine - Hydroxypyridine - Alkylarylthioether - Alpha-acyloxy ketone - Alkyl aryl ether - Benzenoid - Pyridine - Monosaccharide - Acyloin - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Tertiary alcohol - Secondary ketimine - Enone - Cyclic alcohol - Alpha-hydroxy ketone - Acryloyl-group - Cyclic ketone - Thioenolether - Ketone - Ketimine - Carboxylic acid ester - Azacycle - Chloroalkene - Haloalkene - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Vinyl halide - Vinyl chloride - Thioether - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Imine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 20-oxosteroids. These are steroid derivatives carrying a C=O group at the 20-position of the steroid skeleton.
External Descriptors
Not available