1.0 2010-04-08 22:15:45 UTC 2019-11-26 03:20:30 UTC FDB021522 N2-Maltulosylarginine Constituent of Korean red ginseng. N2-Maltulosylarginine is found in tea. N2-Maltulosylarginine UK II C18H34N4O12 498.4822 498.217322572 5-carbamimidamido-2-{[(2,3,4-trihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methyl]amino}pentanoic acid 5-carbamimidamido-2-{[(2,3,4-trihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methyl]amino}pentanoic acid 162966-06-5 NC(=N)NCCCC(NCC1(O)OCC(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)C(O)=O InChI=1S/C18H34N4O12/c19-17(20)21-3-1-2-7(15(29)30)22-6-18(31)14(28)11(25)9(5-32-18)34-16-13(27)12(26)10(24)8(4-23)33-16/h7-14,16,22-28,31H,1-6H2,(H,29,30)(H4,19,20,21) ZAZHPBXBNGWCDV-UHFFFAOYSA-N belongs to the class of organic compounds known as saccharolipids. Saccharolipids are compounds in which fatty acids are linked directly to a sugar backbone, forming structures that are compatible with membrane bilayers. In the saccharolipids, a sugar substitutes for the glycerol backbone that is present in glycerolipids and glycerophospholipids. The most familiar saccharolipids contain an acylated glucosamine. In contrast to others glycolipids, the fatty acid is not glycosidically linked to the sugar moiety. Saccharolipids Organic compounds Lipids and lipid-like molecules Saccharolipids Aliphatic heteromonocyclic compounds Acetals Alpha amino acids Amino acids Arginine and derivatives Carbonyl compounds Carboximidamides Carboxylic acids Dialkylamines Disaccharides Guanidines Hemiacetals Heterocyclic fatty acids Hydrocarbon derivatives Hydroxy fatty acids Imines Monocarboxylic acids and derivatives O-glycosyl compounds Organic oxides Organopnictogen compounds Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Acetal Alcohol Aliphatic heteromonocyclic compound Alpha-amino acid Alpha-amino acid or derivatives Amine Amino acid Amino acid or derivatives Arginine or derivatives Carbonyl group Carboximidamide Carboxylic acid Carboxylic acid derivative Disaccharide Fatty acid Fatty acyl Glycosyl compound Guanidine Hemiacetal Heterocyclic fatty acid Hydrocarbon derivative Hydroxy fatty acid Imine Monocarboxylic acid or derivatives O-glycosyl compound Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Oxane Polyol Primary alcohol Saccharolipid Secondary alcohol Secondary aliphatic amine Secondary amine logp -3.36 ALOGPS logs -1.40 ALOGPS solubility 1.97e+01 g/l ALOGPS melting_point Mp 158-160° logp -6.9 ChemAxon pka_strongest_acidic 1.5 ChemAxon pka_strongest_basic 11.85 ChemAxon iupac 5-carbamimidamido-2-{[(2,3,4-trihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methyl]amino}pentanoic acid ChemAxon average_mass 498.4822 ChemAxon mono_mass 498.217322572 ChemAxon smiles NC(=N)NCCCC(NCC1(O)OCC(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)C(O)=O ChemAxon formula C18H34N4O12 ChemAxon inchi InChI=1S/C18H34N4O12/c19-17(20)21-3-1-2-7(15(29)30)22-6-18(31)14(28)11(25)9(5-32-18)34-16-13(27)12(26)10(24)8(4-23)33-16/h7-14,16,22-28,31H,1-6H2,(H,29,30)(H4,19,20,21) ChemAxon inchikey ZAZHPBXBNGWCDV-UHFFFAOYSA-N ChemAxon polar_surface_area 280.53 ChemAxon refractivity 119.21 ChemAxon polarizability 48.57 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 16 ChemAxon donor_count 12 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22383 Specdb::CMs 47376 Specdb::CMs 160245 Specdb::CMs 167887 Specdb::CMs 280631 Specdb::MsMs 315715 Specdb::MsMs 315716 Specdb::MsMs 315717 Specdb::MsMs 361792 Specdb::MsMs 361793 Specdb::MsMs 361794 Specdb::MsMs 2412868 Specdb::MsMs 2412869 Specdb::MsMs 2412870 Specdb::MsMs 2550168 Specdb::MsMs 2550169 Specdb::MsMs 2550170 Specdb::NmrOneD 47342 Specdb::NmrOneD 47343 Specdb::NmrOneD 47344 Specdb::NmrOneD 47345 Specdb::NmrOneD 47346 Specdb::NmrOneD 47347 Specdb::NmrOneD 47348 Specdb::NmrOneD 47349 Specdb::NmrOneD 47350 Specdb::NmrOneD 47351 Specdb::NmrOneD 47352 Specdb::NmrOneD 47353 Specdb::NmrOneD 47354 Specdb::NmrOneD 47355 Specdb::NmrOneD 47356 Specdb::NmrOneD 47357 Specdb::NmrOneD 47358 Specdb::NmrOneD 47359 Specdb::NmrOneD 47360 Specdb::NmrOneD 47361 HMDB41542 #<Reference:0x00007f093c108c58> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442