Glyceryl 1,3-dipalmitate
PubChem CID: 68149
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| Compound Synonyms | 1,3-Dipalmitin, 502-52-3, Glyceryl 1,3-dipalmitate, 1,3-Dipalmitoyl-glycerol, 1,3-Dipalmitoylglycerol, Glycerol 1,3-dipalmitate, 2-Hydroxypropane-1,3-diyl dipalmitate, 1,3-Di-(hexadecanoyl)-glycerol, Glyceryl dipalmitate, 1,3-Dihexadecanoylglycerol, alpha,gamma-dipalmitin, 2-hydroxypropane-1,3-diyl dihexadecanoate, Glycerol dipalmitate, (3-hexadecanoyloxy-2-hydroxypropyl) hexadecanoate, Hexadecanoic acid, 2-hydroxy-1,3-propanediyl ester, Palmitin, 1,3-di-, 1,3-Dipalmitoylglycerin, Glycerol 1,3-dihexadecanoate, CHEBI:77619, 52PAE2F168, Hexadecanoic acid, diester with 1,2,3-propanetriol, 1,3-Dihexa-decanoyl-rac-glycerol, UNII-52PAE2F168, ,-Dipalmitin, a,a'-Dipalmitin, 1,3-Dipalmitin, 1,3-Dipalmitoylglycerin, 1,3-Dipalmitoylglycerol, Glycerol 1,3-Dihexadecanoate, Hexadecanoic Acid, 2-hydroxy-1,3-propanediyl Ester, EINECS 207-942-3, 1,3-Di-Palmitin, 1,3-Dipalmitoyl glycerol, .alpha.,.gamma.-Dipalmitin, 3-(hexadecanoyloxy)-2-hydroxypropyl hexadecanoate, (3-hexadecanoyloxy-2-hydroxy-propyl) hexadecanoate, SCHEMBL471830, UNII-7775E5IR3L, 1,3-Di-O-hexadecanoylglycerol, CHEMBL2074860, DTXSID40964531, GLYCEROL-1,3-DIPALMITATE, Glycerol 1,2(3)-dihexadecanoate, 7775E5IR3L, Glycerol 1 pound not3-Dipalmitate, EINECS 247-886-7, 1,3-di(hexadecanoyloxy)-2-propanol, BBL010948, Glyceryl 1,3-dipalmitate, >=99%, MFCD00042877, s5745, STK802054, AKOS005622728, Diacylglycerol(16:0/0:0/16:0), BP-29843, DA-59803, FD111137, PD069854, VS-02764, AI3-03501, HY-128792, CS-0141730, NS00013697, 2-Hydroxy-3-(palmitoyloxy)propyl palmitate #, DAG(16:0/0:0/16:0), Hexadecanoic acid 2-hydroxy-1,3-propanediyl ester, DG(16:0/0:0/16:0), Q27147217, HEXADECANOIC ACID, 1,1'-(2-HYDROXY-1,3-PROPANEDIYL) ESTER |
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| Topological Polar Surface Area | 72.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 40.0 |
| Description | Constituent of Panax ginseng (ginseng). Glycerol 1,3-dihexadecanoate is found in tea. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 490.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Enzyme Uniprot Id | P16233, P11150, P54315, Q9NST1, P07098, Q9Y5X9, O75907, P54317, P06858, Q99999, O95674, P49585, Q8NHU3, Q86VZ5, Q3SYC2, P41247, Q96PD7, Q96PD6, Q58HT5, Q6E213, Q6ZPD8, Q6IED9, Q86VF5, Q96AD5, Q17RR3, A9JR72, Q6VAB6, Q63HR2, Q8IVT5, Q8IWQ7 |
| Iupac Name | (3-hexadecanoyloxy-2-hydroxypropyl) hexadecanoate |
| Prediction Hob | 0.0 |
| Class | Glycerolipids |
| Xlogp | 14.0 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Diradylglycerols |
| Molecular Formula | C35H68O5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | GFAZGHREJPXDMH-UHFFFAOYSA-N |
| Fcsp3 | 0.9428571428571428 |
| Rotatable Bond Count | 34.0 |
| State | Solid |
| Synonyms | 1-Hexadecanoyl-3-hexadecanoyl-sn-glycerol, 1-Palmitoyl-3-palmitoyl-sn-glycerol, 1,3-Di-(hexadecanoyl)-glycerol, 1,3-Di-O-hexadecanoylglycerol, 1,3-Di(hexadecanoyloxy)-2-propanol, 1,3-Dihexa-decanoyl-rac-glycerol, 1,3-Dihexadecanoylglycerol, 1,3-Dipalmitin, 1,3-Dipalmitoyl-glycerol, 1,3-DIPALMITOYLGLYCEROL, 2-Hydroxypropane-1,3-diyl dipalmitate, 2-Hydroxypropane-1,3-diyl dipalmitic acid, a,a'-Dipalmitin, Alpha,gamma-dipalmitin, DAG(16:0/0:0/16:0), DAG(32:0), DG(16:0/0:0/16:0), DG(32:0), Diacylglycerol(16:0/0:0/16:0), Diacylglycerol(32:0), Dipalmitin, Glycerol 1,3-dipalmitate, Glycerol dipalmitate, Glyceryl 1,3-dipalmitate, Glyceryl 1,3-dipalmitic acid, Glyceryl dipalmitate, Hexadecanoic acid 2-hydroxy-1,3-propanediyl ester, Hexadecanoic acid, 2-hydroxy-1,3-propanediyl ester, Hexadecanoic acid, diester with 1,2,3-propanetriol, Palmitin, 1,3-di-, Glycerol 1,3-dihexadecanoic acid, Diglyceride, Diacylglycerol, 1-hexadecanoyl-3-hexadecanoyl-sn-glycerol, 1-palmitoyl-3-palmitoyl-sn-glycerol, 1,3-Di-palmitin, a,A'-dipalmitin, alpha,gamma-Dipalmitin, 1,2-Dipalmitoyl glycerol |
| Compound Name | Glyceryl 1,3-dipalmitate |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 568.507 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 568.507 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 568.9 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Esol | -9.968528800000003 |
| Inchi | InChI=1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-31-33(36)32-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3 |
| Smiles | CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)O |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | 1,3-diacylglycerols |
- 1. Outgoing r'ship
FOUND_INto/from Nelumbo Nucifera (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all