Compound Identification
SMILES
CC(=O)OCC1(C)C(CCC2(C)C1CCC1(C)OC3=C(CC21)C(=O)OC(=C3)C1=CC=CC=C1)OC(C)=O
InChIKey
InChIKey=CBPHTUXBOQCTIG-UHFFFAOYSA-N
Formula
C30H36O7
Mass
508.611
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
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Steroids and steroid derivatives
Alternative Parents
Naphthopyrans Naphthalenes Pyranones and derivatives Alkyl aryl ethers Dicarboxylic acids and derivatives Benzene and substituted derivatives Vinylogous esters Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Steroid - Naphthopyran - Naphthalene - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous ester - Carboxylic acid ester - Lactone - Oxacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as steroids and steroid derivatives. These are compounds based on the cyclopenta[a]phenanthrene carbon skeleton, partially or completely hydrogenated; there are usually methyl groups at C-10 and C-13, and often an alkyl group at C-17. By extension, one or more bond scissions, ring expansions and/or ring contractions of the skeleton may have occurred.
External Descriptors
Not available