Compound Identification
SMILES
CC(C)CCCC(C)CCCC(C)CCCC1(C)CCC2=C(C(O)=O)C(O)=C(C)C(C)=C2O1
InChIKey
InChIKey=SHMOVXNTBAZRNU-UHFFFAOYSA-N
Formula
C29H48O4
Mass
460.699
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Quinone and hydroquinone lipids
-
Level 5
Vitamin E compounds
- Level 6 Tocopherols
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Level 5
Vitamin E compounds
-
Subclass
Quinone and hydroquinone lipids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Quinone and hydroquinone lipids
Intermediate Tree Nodes
Vitamin E compounds
Direct Parent
Tocopherols
Alternative Parents
Diterpenoids Salicylic acid and derivatives 1-benzopyrans Phenols Alkyl aryl ethers Vinylogous acids Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tocopherol - Diterpenoid - Chromane - Benzopyran - Hydroxybenzoic acid - 1-benzopyran - Salicylic acid or derivatives - Alkyl aryl ether - Phenol - Benzenoid - Vinylogous acid - Organoheterocyclic compound - Ether - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tocopherols. These are vitamin E derivatives containing a saturated trimethyltridecyl chain attached to the carbon C6 atom of a benzopyran ring system. The differ from tocotrienols that contain an unsaturated trimethyltrideca-3,7,11-trien-1-yl chain.
External Descriptors
Not available