1.0 2016-09-30 22:46:07 UTC 2020-05-21 16:28:36 UTC BMDB0001448 BMDB01448 Sulfate [S(OH)2O2] [SO2(OH)2] Acide sulfurique Acido sulfurico Acidum sulfuricum H2SO4 Schwefelsaeureloesungen Sulphuric acid Sulfuric acid Acide sulphurique Acido sulphurico Acidum sulphuricum Sulphate Sulfate H2O4S 98.078 97.967379242 sulfuric acid sulfuric acid 14808-79-8 OS(O)(=O)=O InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4) QAOWNCQODCNURD-UHFFFAOYSA-N belongs to the class of inorganic compounds known as non-metal sulfates. These are inorganic non-metallic compounds containing a sulfate as its largest oxoanion. Inorganic compounds Homogeneous non-metal compounds Non-metal oxoanionic compounds Non-metal sulfates Non-metal sulfates Inorganic oxides Organic sulfuric acids Inorganic oxide Non-metal sulfate Sulfuric acid sulfur oxoacid Solid logp -0.84 ChemAxon pka_strongest_acidic -3 ChemAxon iupac sulfuric acid ChemAxon average_mass 98.078 ChemAxon mono_mass 97.967379242 ChemAxon smiles OS(O)(=O)=O ChemAxon formula H2O4S ChemAxon inchi InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4) ChemAxon inchikey QAOWNCQODCNURD-UHFFFAOYSA-N ChemAxon polar_surface_area 74.6 ChemAxon refractivity 13.77 ChemAxon polarizability 6.51 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 4 ChemAxon donor_count 2 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 935 Specdb::CMs 31783 Specdb::CMs 168848 Specdb::MsIr 1280 Specdb::MsIr 1281 Specdb::MsIr 1282 Specdb::MsMs 29621 Specdb::MsMs 29622 Specdb::MsMs 29623 Specdb::MsMs 36179 Specdb::MsMs 36180 Specdb::MsMs 36181 Specdb::MsMs 439730 Specdb::MsMs 439747 Specdb::MsMs 439820 Specdb::MsMs 439821 Specdb::MsMs 449815 Specdb::MsMs 449816 Specdb::MsMs 449859 Specdb::MsMs 449884 Specdb::MsMs 449919 Specdb::MsMs 450028 Specdb::MsMs 450029 Specdb::MsMs 450030 Specdb::MsMs 450031 Specdb::MsMs 2429548 Specdb::MsMs 2429549 Specdb::MsMs 2429550 Specdb::MsMs 2506139 Specdb::MsMs 2506140 Specdb::MsMs 2506141 Liver 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under corn stover based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 Liver 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under alfalfa hay based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 Mammary Gland 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under corn stover based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 Mammary Gland 8 multiparous Chinese Holstein dairy cows fed in the Hangzhou Hangjiang Dairy Farm based on the milk production under alfalfa hay based diets. Detection used gas chromatography time-of-flight/mass spectrometry (GC-TOF/MS) platform. Sun HZ, Zhou M, Wang O, Chen Y, Liu JX, Guan LL: Multi-omics reveals functional genomic and metabolic mechanisms of milk production and quality in dairy cows. Bioinformatics. 2020 Apr 15;36(8):2530-2537. doi: 10.1093/bioinformatics/btz951. 31873721 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 DB11309 FDB013392 1086 1117 26836 C00059 C00007530 NH42SO4 33697 Sulfuric_acid 3233 Zhang, Qiu-Ju; Wang, Xiao; Chen, Jian-Min; Zhuang, Guo-Shun. Formation of Fe(II) (aq) and sulfate via heterogeneous reaction of SO2 with Fe2O3. Gaodeng Xuexiao Huaxue Xuebao (2006), 27(7), 1347-1350. BMDBP00031 Sulfite oxidase Q3MHX0 SUOX Enzyme BMDBP00081 Arylsulfatase A Q08DD1 ARSA Enzyme BMDBP00113 Mercaptopyruvate sulfurtransferase Q3MHG3 MPST Enzyme BMDBP00114 Thiosulfate sulfurtransferase P00586 TST Enzyme BMDBP00115 Heparanase Q9MYY0 HPSE Enzyme BMDBP01345 Cartilage oligomeric matrix protein P35445 COMP Enzyme BMDBP01346 Sulfurtransferase A8R4B3 TSTD3 Enzyme BMDBP01347 Solute carrier family 26 member 6 Q08DQ8 SLC26A6 Enzyme BMDBP01348 Testis anion transporter 1 A6QNW6 SLC26A8 Enzyme BMDBP01349 Vascular endothelial growth factor A P15691 VEGFA Enzyme BMDBP01350 Sodium-independent sulfate anion transporter Q58DD2 SLC26A11 Enzyme BMDBP01351 Prolargin Q9GKN8 PRELP Enzyme BMDBP01352 Sulfate transporter Q9BEG8 SLC26A2 Enzyme BMDBP01353 Adhesion G protein-coupled receptor E5 Q8SQA4 ADGRE5 Enzyme BMDBP01354 Chloride anion exchanger A4IFH8 SLC26A3 Enzyme BMDBP02900 3'-phosphoadenosine 5'-phosphosulfate synthase 2 Q0VC88 PAPSS2 Enzyme