Compound Identification
SMILES
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(OCC1=CC=CC=C1)O[C@H]1[C@H](OCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@H](OP(=O)(OCC2=CC=CC=C2)OCC2=CC=CC=C2)[C@@H](OP(=O)(OCC2=CC=CC=C2)OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCC
InChIKey
InChIKey=YYCNNVGBDNFMHI-FROBQRDLSA-N
Formula
C97H129O19P3
Mass
1692.001
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
- Class Glycerophospholipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Glycerophospholipids
Subclass
Glycerophosphoinositol phosphates
Intermediate Tree Nodes
Phosphatidylinositol phosphates
Direct Parent
1-phosphatidyl-1D-myo-inositol-3,4-bisphosphates
Alternative Parents
1-phosphatidyl-1D-myo-inositol-4,5-bisphosphates Phosphatidylinositols Inositol phosphates Benzylethers Trialkyl phosphates Fatty acid esters Dicarboxylic acids and derivatives Carboxylic acid esters Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
1-phosphatidyl-1d-myo-inositol-3,4-bisphosphate - 1-phosphatidyl-1d-myo-inositol-4,5-bisphosphate - Diacylglycerophosphoinositol-4,5-bisphosphate - Diacylglycerophosphoinositol - Glycerophosphoinositol - Inositol phosphate - Benzylether - Trialkyl phosphate - Fatty acid ester - Fatty acyl - Benzenoid - Alkyl phosphate - Phosphoric acid ester - Organic phosphoric acid derivative - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Cyclitol or derivatives - Carboxylic acid ester - Ether - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1-phosphatidyl-1d-myo-inositol-3,4-bisphosphates. These are lipids containing a myo-inositol-3,4-bisphosphate attached to the phosphate group of a glycerol-3-phosphate moiety, and two acyl chains linked to the glycerol at the O1- and O2- positions, through ester linkages.
External Descriptors
Not available