1.0 2010-04-08 22:15:46 UTC 2019-11-26 03:20:32 UTC FDB021549 D-1,5-Anhydrofructose Isolated from Morchella vulgaris (morel). D-1,5-Anhydrofructose is found in fruits. 1,5-Anhydro-D-fructose 1,5-Anhydrofructose 1:5-Anhydro-D-fructose 15-ANHYDRO-D-FRUCTOSE D-Fructose, 1:5-anhydro- C6H10O5 162.1406 162.05282343 4,5-dihydroxy-6-(hydroxymethyl)oxan-3-one 4,5-dihydroxy-6-(hydroxymethyl)oxan-3-one 75414-43-6 OCC1OCC(=O)C(O)C1O InChI=1S/C6H10O5/c7-1-4-6(10)5(9)3(8)2-11-4/h4-7,9-10H,1-2H2 OCLOLUFOLJIQDC-UHFFFAOYSA-N belongs to the class of organic compounds known as oxanes. Oxanes are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms. Oxanes Organic compounds Organoheterocyclic compounds Oxanes Aliphatic heteromonocyclic compounds Cyclic ketones Dialkyl ethers Hydrocarbon derivatives Organic oxides Oxacyclic compounds Primary alcohols Secondary alcohols Alcohol Aliphatic heteromonocyclic compound Carbonyl group Cyclic ketone Dialkyl ether Ether Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Oxacycle Oxane Primary alcohol Secondary alcohol a small molecule logp -1.84 ALOGPS logs 0.77 ALOGPS solubility 9.65e+02 g/l ALOGPS melting_point Mp 107-112° logp -2.1 ChemAxon pka_strongest_acidic 11.27 ChemAxon pka_strongest_basic -3 ChemAxon iupac 4,5-dihydroxy-6-(hydroxymethyl)oxan-3-one ChemAxon average_mass 162.1406 ChemAxon mono_mass 162.05282343 ChemAxon smiles OCC1OCC(=O)C(O)C1O ChemAxon formula C6H10O5 ChemAxon inchi InChI=1S/C6H10O5/c7-1-4-6(10)5(9)3(8)2-11-4/h4-7,9-10H,1-2H2 ChemAxon inchikey OCLOLUFOLJIQDC-UHFFFAOYSA-N ChemAxon polar_surface_area 86.99 ChemAxon refractivity 34.05 ChemAxon polarizability 14.77 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 9230 Specdb::MsMs 9231 Specdb::MsMs 9232 Specdb::MsMs 15902 Specdb::MsMs 15903 Specdb::MsMs 15904 Specdb::MsMs 2285791 Specdb::MsMs 2285792 Specdb::MsMs 2285793 Specdb::MsMs 3083103 Specdb::MsMs 3083104 Specdb::MsMs 3083105 Specdb::NmrOneD 47462 Specdb::NmrOneD 47463 Specdb::NmrOneD 47464 Specdb::NmrOneD 47465 Specdb::NmrOneD 47466 Specdb::NmrOneD 47467 Specdb::NmrOneD 47468 Specdb::NmrOneD 47469 Specdb::NmrOneD 47470 Specdb::NmrOneD 47471 Specdb::NmrOneD 47472 Specdb::NmrOneD 47473 Specdb::NmrOneD 47474 Specdb::NmrOneD 47475 Specdb::NmrOneD 47476 Specdb::NmrOneD 47477 Specdb::NmrOneD 47478 Specdb::NmrOneD 47479 Specdb::NmrOneD 47480 Specdb::NmrOneD 47481 Specdb::CMs 16868 Specdb::CMs 47384 Specdb::CMs 122417 Specdb::CMs 130791 Specdb::CMs 138525 Specdb::CMs 808253 Specdb::CMs 808254 Specdb::CMs 808255 Specdb::CMs 808256 Specdb::CMs 808257 Specdb::CMs 808258 Specdb::CMs 808259 Specdb::CMs 808260 Specdb::CMs 808261 Specdb::CMs 808262 Specdb::CMs 808263 Specdb::CMs 808264 Specdb::CMs 808265 Specdb::CMs 808266 Specdb::CMs 808267 Specdb::CMs 808268 Specdb::CMs 808269 Specdb::CMs 808270 Specdb::CMs 808271 Specdb::CMs 808272 HMDB41561 #<Reference:0x000055ce3061eb68> Fruits Unknown generic