Compound Identification
SMILES
[2H]C([2H])=C1\C(=C(\C)/C(/[2H])=C2/[C@@H]3CC[C@H]([C@](C)(C(C)C)C(C)CC(C)C(O)(CC)CC)[C@@]3(C(C)C)C(C)(C)C(C)(C)C2(C)C)C(C)(C)[C@@](C)(O)[C@@]([2H])(OCC(C)CO)[C@]1([2H])O
InChIKey
InChIKey=LMDNURWQDSYJPI-HULYAFHDSA-N
Formula
C50H90O5
Mass
776.296
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 Cyclitols and derivatives Tertiary alcohols Secondary alcohols Dialkyl ethers Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Triterpenoid - Cyclitol or derivatives - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic homopolycyclic 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