1.0 2016-05-19 02:27:50 UTC 2026-04-03 10:12:20 UTC SUCROSE MONOPALMITATE SmallMolecule SUCROSE MONOPALMITATE (C28H52O12) is an organic compound used industrially as a nutrient and flavouring. SUCROSE MONOPALMITATE belongs to the carbohydrates and carbohydrate conjugates, a subclass of organooxygen compounds within the organic compounds. With an average molecular weight of 580.71 g/mol, SUCROSE MONOPALMITATE is a heavy molecule. This compound is identified in three recorded sources. Within the category of food, food processing, and cookware, it is associated with the treatment of hops and the preparation of malt. Additionally, it is found in household cleaning and consumer products, specifically within tobacco product cases. C28H52O12 580.712 580.345877114 (2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl hexadecanoate (2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl hexadecanoate 26446-38-8 [H][C@]1(CO)O[C@@](CO)(O[C@@]2([H])O[C@]([H])(CO)[C@@]([H])(O)[C@]([H])(O)[C@@]2([H])O)[C@@]([H])(OC(=O)CCCCCCCCCCCCCCC)[C@]1([H])O InChI=1S/C28H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(32)38-26-23(34)20(17-30)39-28(26,18-31)40-27-25(36)24(35)22(33)19(16-29)37-27/h19-20,22-27,29-31,33-36H,2-18H2,1H3/t19-,20-,22-,23-,24+,25-,26+,27-,28+/m1/s1 ODCGMAWJSFNWJQ-ZRVLSRDKSA-N Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates O-glycosyl compounds C-glycosyl compounds Carbonyl compounds Carboxylic acid esters Disaccharides Fatty acid esters Hydrocarbon derivatives Ketals Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Tetrahydrofurans Acetal Alcohol Aliphatic heteromonocyclic compound C-glycosyl compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Disaccharide Fatty acid ester Fatty acyl Hydrocarbon derivative Ketal Monocarboxylic acid or derivatives O-glycosyl compound Organic oxide Organoheterocyclic compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Tetrahydrofuran Aliphatic heteromonocyclic compounds Detected and Not Quantified logp 2.40 ALOGPS logs -3.12 ALOGPS solubility 4.43e-01 g/l ALOGPS logp 2.39 ChemAxon pka_strongest_acidic 12.11 ChemAxon pka_strongest_basic -3 ChemAxon iupac (2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl hexadecanoate ChemAxon average_mass 580.712 ChemAxon mono_mass 580.345877114 ChemAxon smiles [H][C@]1(CO)O[C@@](CO)(O[C@@]2([H])O[C@]([H])(CO)[C@@]([H])(O)[C@]([H])(O)[C@@]2([H])O)[C@@]([H])(OC(=O)CCCCCCCCCCCCCCC)[C@]1([H])O ChemAxon formula C28H52O12 ChemAxon inchi InChI=1S/C28H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(32)38-26-23(34)20(17-30)39-28(26,18-31)40-27-25(36)24(35)22(33)19(16-29)37-27/h19-20,22-27,29-31,33-36H,2-18H2,1H3/t19-,20-,22-,23-,24+,25-,26+,27-,28+/m1/s1 ChemAxon inchikey ODCGMAWJSFNWJQ-ZRVLSRDKSA-N ChemAxon polar_surface_area 195.6 ChemAxon refractivity 142.37 ChemAxon polarizability 64.49 ChemAxon rotatable_bond_count 21 ChemAxon acceptor_count 11 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7224da4e20> 21140494 20003730