Compound Identification
SMILES
CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@]1(C)CC=C1[C@@]3(C)CC[C@@H](C[C@]33C=C[C@]21C1C3C(=O)OC1=O)OC(C)=O
InChIKey
InChIKey=XCRYSOZAEGNUJX-CLEOSXMPSA-N
Formula
C29H34O8
Mass
510.583
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Vitamin D and derivatives
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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
Vitamin D and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Vitamin D and derivatives
Alternative Parents
Triterpenoids Steroid esters Tetracarboxylic acids and derivatives Fatty alcohol esters Alpha-acyloxy ketones Monosaccharides Tetrahydrofurans Carboxylic acid anhydrides Ketones Carboxylic acid esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Steroid ester - Tetracarboxylic acid or derivatives - Fatty alcohol ester - Alpha-acyloxy ketone - Monosaccharide - Tetrahydrofuran - Carboxylic acid anhydride - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as vitamin d and derivatives. These are compounds containing a secosteroid backbone, usually secoergostane or secocholestane.
External Descriptors
Not available