Compound Identification
SMILES
CC(C)=C[C@H]1C[C@](C)(O)C2C3CCC4[C@@]5(C)CCC[C@](C)(O[C@H]6OC[C@H](O)[C@H](OC7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@H]6C[C@H](CO)[C@@H](O)[C@@H]6O)C5CC[C@@]4(C)[C@@]33CO[C@@]2(C3)O1
InChIKey
InChIKey=XRFBJUCOZPQFJH-TZBBDDFWSA-N
Formula
C46H74O16
Mass
883.082
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
Sesquiterpenoids Naphthopyrans O-glycosyl compounds Disaccharides Naphthalenes Ketals Pyrans Cyclitols and derivatives Oxanes Cyclopentanols Tetrahydrofurans Tertiary alcohols Polyols Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steroid - Sesquiterpenoid - Naphthopyran - Disaccharide - Glycosyl compound - O-glycosyl compound - Naphthalene - Ketal - Cyclitol or derivatives - Cyclopentanol - Oxane - Pyran - Tetrahydrofuran - Cyclic alcohol - Tertiary alcohol - Secondary alcohol - Polyol - Organoheterocyclic compound - Oxacycle - Ether - Dialkyl ether - Acetal - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Primary alcohol - Aliphatic 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