1.0 2016-09-30 23:02:25 UTC 2020-05-11 20:49:08 UTC BMDB0002994 BMDB02994 Erythritol (2R,3S)-Butane-1,2,3,4-tetrol Erythrit Erythrite Erythro-tetritol Erythrol L-Erythritol MESO-erythritol Mesoerythritol Phycite Phycitol 1,2,3,4-Butanetetrol Antierythrite Butanetetrol C*Eridex Erythroglucin I-erythritol L-(-)-Threitol L-Threitol Lichen sugar Meso-eythritol Paycite Tetrahydroxybutane 1,2,3,4-Tetrahydroxybutane C4H10O4 122.1198 122.057908808 (2R,3S)-butane-1,2,3,4-tetrol erythritol 149-32-6 OC[C@H](O)[C@H](O)CO InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2/t3-,4+ UNXHWFMMPAWVPI-ZXZARUISSA-N belongs to the class of organic compounds known as sugar alcohols. These are hydrogenated forms of carbohydrate in which the carbonyl group (aldehyde or ketone, reducing sugar) has been reduced to a primary or secondary hydroxyl group. Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Sugar alcohols Hydrocarbon derivatives Polyols Primary alcohols Secondary alcohols Alcohol Aliphatic acyclic compound Hydrocarbon derivative Polyol Primary alcohol Secondary alcohol Sugar alcohol Aliphatic acyclic compounds butane-1,2,3,4-tetrol Solid melting_point 121.5 °C water_solubility 610 mg/mL at 22 °C logp -2.29 HANSCH,C ET AL. (1995) logp -2.03 ALOGPS logs 0.98 ALOGPS logp -2.5 ChemAxon pka_strongest_acidic 13.04 ChemAxon pka_strongest_basic -3 ChemAxon iupac (2R,3S)-butane-1,2,3,4-tetrol ChemAxon average_mass 122.1198 ChemAxon mono_mass 122.057908808 ChemAxon smiles OC[C@H](O)[C@H](O)CO ChemAxon formula C4H10O4 ChemAxon inchi InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2/t3-,4+ ChemAxon inchikey UNXHWFMMPAWVPI-ZXZARUISSA-N ChemAxon polar_surface_area 80.92 ChemAxon refractivity 26.48 ChemAxon polarizability 11.62 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 4 ChemAxon physiological_charge 0 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::MsIr 1855 Specdb::MsIr 1856 Specdb::MsIr 1857 Specdb::NmrTwoD 1855 Specdb::EiMs 1993 Specdb::CMs 828 Specdb::CMs 1184 Specdb::CMs 7764 Specdb::CMs 30156 Specdb::CMs 30625 Specdb::CMs 31436 Specdb::CMs 38508 Specdb::CMs 133727 Specdb::CMs 141461 Specdb::NmrOneD 1920 Specdb::NmrOneD 10502 Specdb::NmrOneD 10503 Specdb::NmrOneD 10504 Specdb::NmrOneD 10505 Specdb::NmrOneD 10506 Specdb::NmrOneD 10507 Specdb::NmrOneD 10508 Specdb::NmrOneD 10509 Specdb::NmrOneD 10510 Specdb::NmrOneD 10511 Specdb::NmrOneD 10512 Specdb::NmrOneD 10513 Specdb::NmrOneD 10514 Specdb::NmrOneD 10515 Specdb::NmrOneD 10516 Specdb::NmrOneD 10517 Specdb::NmrOneD 10518 Specdb::NmrOneD 10519 Specdb::NmrOneD 10520 Specdb::NmrOneD 10521 Specdb::MsMs 2179 Specdb::MsMs 2180 Specdb::MsMs 2181 Specdb::MsMs 255807 Specdb::MsMs 255808 Specdb::MsMs 255809 Specdb::MsMs 275748 Specdb::MsMs 275749 Specdb::MsMs 275750 Specdb::MsMs 1471250 Specdb::MsMs 1471308 Specdb::MsMs 1473064 Specdb::MsMs 1473065 Specdb::MsMs 1473066 Specdb::MsMs 1473067 Specdb::MsMs 1473068 Specdb::MsMs 1473069 Specdb::MsMs 1473070 Specdb::MsMs 1473071 Specdb::MsMs 1473072 Specdb::MsMs 1473073 Specdb::MsMs 1473074 Specdb::MsMs 1473075 Specdb::MsMs 1473076 Specdb::MsMs 1473077 Epidermis Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Placenta Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Prostate Tissue Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 Semen Analysis was performed using GC-MS in Holstein bulls (n = 16). Compound was identified by probable match parameters of the NIST Mass Spectral Search Program Velho ALC, Menezes E, Dinh T, Kaya A, Topper E, Moura AA, Memili E: Metabolomic markers of fertility in bull seminal plasma. PLoS One. 2018 Apr 10;13(4):e0195279. doi: 10.1371/journal.pone.0195279. eCollection 2018. 29634739 192963 C00503 DB04481 FDB000371 222285 MRY 17113 ERYTHRITOL C00001161 Erythritol 140 New Synthesis of Natural and of Racemic Erythrite. Pariselle, H. Compt. rend. (1910), 150 1343-6.