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1-Monopalmitoylglycerol
ScientificNameLabel
1-Monopalmitoylglycerol
PHCD compound ID :
3911
Chemical Names :
1-Monopalmitoylglycerol
Molecular Formula :
C19H38O4
Molecular Weight :
330.27701
More Details :
Names & Synonyms:
2,3-dihydroxypropyl hexadecanoate , hexadecanoic acid 2,3-dihydroxypropyl ester , 2,3-bis(oxidanyl)propyl hexadecanoate , palmitic acid glyceryl ester
Smiles:
CCCCCCCCCCCCCCCC(=O)OC[C@H](CO)O
InChi :
InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3/t18-/m0/s1
InChi Key :
InChIKey=QHZLMUACJMDIAE-SFHVURJKSA-N
PubChem ID :
14900
Rotatable bond count :
18
Rule of five :
2
Hydrogen bond acceptor count :
4
Ionization potential :
10.262418
Hydrogen bond donor count :
2
Electric dipole moment :
3.076
XLogP :
6.51
VDW volume :
369.704615
Molecular weight :
330.27701
HOMO-LUMO gap :
11.369000
Herb list :
Jujube - Ziziphus jujuba - عناب
Refrences & Litretures:
533. Journal:'Analyst' Year:'2013' Volume:'138' Page:'6881' DOI:'10.1039/c3an01478a' Title:'Phytochemical analyses of Ziziphus jujuba Mill. var. spinosa seed by ultrahigh performance liquid chromatography-tandem mass spectrometry and gas chromatography-mass spectrometry'
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