Compound Identification
SMILES
CCCCCCCC\C=C\C(=O)O[C@@H]1[C@@H](C)[C@]2(O)[C@@H]3C=C(C)C(=O)[C@@]3(O)C=C(CO)[C@H](OO)[C@H]2[C@@H]2C(C)(C)[C@]12OC(C)=O
InChIKey
InChIKey=KRBKMIARJGAHGD-PENBSUHMSA-N
Formula
C33H48O10
Mass
604.737
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Diterpenoids
-
Level 5
Tigliane and ingenane diterpenoids
- Level 6 Phorbol esters
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Level 5
Tigliane and ingenane diterpenoids
-
Subclass
Diterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Tigliane and ingenane diterpenoids
Direct Parent
Phorbol esters
Alternative Parents
Fatty acid esters Dicarboxylic acids and derivatives Tertiary alcohols Enoate esters Ketones Cyclic alcohols and derivatives Peroxols Alkyl hydroperoxides Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Phorbol ester - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Cyclic alcohol - Tertiary alcohol - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Hydroperoxide - Ketone - Carboxylic acid ester - Peroxol - Alkyl hydroperoxide - Carboxylic acid derivative - Primary alcohol - Organic oxide - Organooxygen compound - Organic oxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as phorbol esters. These are tigliane diterpenoids which are esters of phorbol.
External Descriptors
Not available