2-Palmitoleoyl-glycerol

Details

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Internal ID bc570562-0668-4e22-a071-681f44ad082c
Taxonomy Lipids and lipid-like molecules > Glycerolipids > Monoradylglycerols > Monoacylglycerols > 2-monoacylglycerols
IUPAC Name 1,3-dihydroxypropan-2-yl (Z)-hexadec-9-enoate
SMILES (Canonical) CCCCCCC=CCCCCCCCC(=O)OC(CO)CO
SMILES (Isomeric) CCCCCC/C=C\CCCCCCCC(=O)OC(CO)CO
InChI InChI=1S/C19H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-18(16-20)17-21/h7-8,18,20-21H,2-6,9-17H2,1H3/b8-7-
InChI Key CXUXMSACCLYMBI-FPLPWBNLSA-N
Popularity 22 references in papers

Physical and Chemical Properties

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Molecular Formula C19H36O4
Molecular Weight 328.50 g/mol
Exact Mass 328.26135963 g/mol
Topological Polar Surface Area (TPSA) 66.80 Ų
XlogP 5.20

Synonyms

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2-[(9Z)-hexadecenoyl]glycerol
MG(0:0/16:1(9Z)/0:0)
2-palmitoleoylglycerol
SCHEMBL9775032
CHEBI:87254
2-(9Z-hexadecenoyl)-rac-glycerol
MAG(0:0/16:1n7)
MAG(0:0/16:1w7)
MG(0:0/16:1n7)
MG(0:0/16:1w7)
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 2-Palmitoleoyl-glycerol

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3060 Q9Y345 Glycine transporter 2 98.66% 99.17%
CHEMBL230 P35354 Cyclooxygenase-2 97.35% 89.63%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 95.28% 97.29%
CHEMBL2581 P07339 Cathepsin D 94.89% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.23% 96.09%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 91.82% 92.86%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 91.48% 92.08%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 91.28% 85.94%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 89.84% 96.95%
CHEMBL5255 O00206 Toll-like receptor 4 86.60% 92.50%
CHEMBL3359 P21462 Formyl peptide receptor 1 86.40% 93.56%
CHEMBL1781 P11387 DNA topoisomerase I 86.34% 97.00%
CHEMBL299 P17252 Protein kinase C alpha 85.49% 98.03%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 85.00% 100.00%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 84.15% 91.81%
CHEMBL4227 P25090 Lipoxin A4 receptor 81.90% 100.00%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 81.78% 94.33%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 81.41% 100.00%
CHEMBL340 P08684 Cytochrome P450 3A4 80.21% 91.19%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Solanum lycopersicum

Cross-Links

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PubChem 53480960
LOTUS LTS0153327
wikiData Q27159468