Compound Identification
SMILES
CC(=O)OC1CCC2(C)C(C1)CC(OC(C)=O)C1C3CCC(C(C)=CC=C(C4=CC=CC=C4)C4=CC=CC=C4)C3(C)C(CC21)OC(C)=O
InChIKey
InChIKey=XVYLMMNUFPYITC-UHFFFAOYSA-N
Formula
C42H52O6
Mass
652.872
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
Steroid esters Diphenylmethanes Aromatic monoterpenoids Tricarboxylic acids and derivatives Styrenes Carboxylic acid esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cholane-skeleton - Steroid ester - Steroid - Diphenylmethane - Monoterpenoid - Aromatic monoterpenoid - Tricarboxylic acid or derivatives - Styrene - Benzenoid - Monocyclic benzene moiety - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homopolycyclic 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