1.0 2016-09-30 23:23:07 UTC 2020-04-22 15:17:46 UTC BMDB0006534 BMDB06534 D-Xylulose 1-phosphate 1-O-Phosphono-D-erythro-pent-2-ulose D-Erythro-pentulose 1-(dihydrogen phosphate) D-Erythro-pentulose 1-(dihydrogen phosphoric acid) 1-(Dihydrogen phosphate) D-threo-pentulose 1-Phosphate-D-threo-pentulose D-Ribulose 1-phosphoric acid C5H11O8P 230.1098 230.01915384 {[(3R,4R)-3,4,5-trihydroxy-2-oxopentyl]oxy}phosphonic acid D-xylulose 1-phosphate 63323-91-1 OC[C@@H](O)[C@@H](O)C(=O)COP(O)(O)=O InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h3,5-7,9H,1-2H2,(H2,10,11,12)/t3-,5-/m1/s1 NBOCCPQHBPGYCX-NQXXGFSBSA-N belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphated group linked to the carbohydrate unit. Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Monosaccharide phosphates Acyloins Alpha-hydroxy ketones Beta-hydroxy ketones Glycerone phosphates Hydrocarbon derivatives Monoalkyl phosphates Organic oxides Pentoses Polyols Primary alcohols Secondary alcohols Acyloin Alcohol Aliphatic acyclic compound Alkyl phosphate Alpha-hydroxy ketone Beta-hydroxy ketone Carbonyl group Glycerone phosphate Hydrocarbon derivative Ketone Monoalkyl phosphate Monosaccharide phosphate Organic oxide Organic phosphoric acid derivative Pentose monosaccharide Phosphoric acid ester Polyol Primary alcohol Secondary alcohol Aliphatic acyclic compounds ribulose 1-phosphate Solid logp -1.80 ALOGPS logs -0.97 ALOGPS logp -2.8 ChemAxon pka_strongest_acidic 1.18 ChemAxon pka_strongest_basic -3 ChemAxon iupac {[(3R,4R)-3,4,5-trihydroxy-2-oxopentyl]oxy}phosphonic acid ChemAxon average_mass 230.1098 ChemAxon mono_mass 230.01915384 ChemAxon smiles OC[C@@H](O)[C@@H](O)C(=O)COP(O)(O)=O ChemAxon formula C5H11O8P ChemAxon inchi InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h3,5-7,9H,1-2H2,(H2,10,11,12)/t3-,5-/m1/s1 ChemAxon inchikey NBOCCPQHBPGYCX-NQXXGFSBSA-N ChemAxon polar_surface_area 144.52 ChemAxon refractivity 42.47 ChemAxon polarizability 18.28 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 7 ChemAxon donor_count 5 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 22337 Specdb::CMs 39034 Specdb::MsMs 315610 Specdb::MsMs 315611 Specdb::MsMs 315612 Specdb::MsMs 361666 Specdb::MsMs 361667 Specdb::MsMs 361668 18540499 FDB023963 14844436 71687 D-RIBULOSE-1-P 2388820 Ghalambor, Mohammad Ali; Heath, Edward C. Metabolism of L-fucose. II. The enzymic cleavage of 1-fuculose 1-phosphate. Journal of Biological Chemistry (1962), 237 2427-33.