Compound Identification
SMILES
CC(C)CCCC(C)[C@@H]1CCC2[C@H]3CCC4(C)CC5=C(C[C@@]4(C)C3CC[C@@]12C)C(=O)CC1C2CCCCC2CCN51
InChIKey
InChIKey=VDOPMXGFMAMATN-BAPQNEGGSA-N
Formula
C39H63NO
Mass
561.939
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Vitamin D and derivatives
-
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 Cholestane steroids Naphthylisoquinolines Naphthalenes Tetrahydropyridines Piperidines Beta-amino ketones Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Enones Acryloyl compounds Trialkylamines Enamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Cholestane-skeleton - Naphthylisoquinoline - Naphthalene - Isoquinoline - Tetrahydropyridine - Alpha-branched alpha,beta-unsaturated-ketone - Piperidine - Beta-aminoketone - Vinylogous amide - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Organoheterocyclic compound - Enamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - 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