Identification Properties Safety Data Specifications Links Identification CAS Number 475-31-0 Name Glycocholic acid Synonyms 3α,7α,12α-Trihydroxy-5β-cholan-24-oic acid N-(carboxymethyl)amide Cholylglycine N-(3α,7α,12α-Trihydroxy-24-oxocholan-24-yl)-glycine SMILES C[[email protected]](CCC(=O)NCC(=O)O)[[email protected]]1CC[C@@H]2[C@@]1([[email protected]](C[[email protected]]3[[email protected]]2[C@@H](C[[email protected]]4[C@@]3(CC[[email protected]](C4)O)C)O)O)C StdInChI: InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1 StdInChIKey RFDAIACWWDREDC-FRVQLJSFSA-N Beilstein Registry Number 2955826 MDL Number MFCD06408004 Molecular Formula C26H43NO6 Molecular Weight 465.63 Properties Appearance Off-white to white solid Boiling Point 692.042 °C at 760 mmHg Flash Point 372.334 °C…

Identification Properties Safety Data Specifications Links Identification CAS Number 145-42-6 Name Sodium taurocholate hydrate Synonyms 2-[(3α,7α,12α-Trihydroxy-24-oxo-5β-cholan-24-yl)amino]ethanesulfonic acid 3α,7α,12α-Trihydroxy-5β-cholan-24-oic acid N-(2-sulfoethyl)amide Taurocholic acid sodium salt hydrate SMILES [Na+].[O-]S(=O)(=O)CCNC(=O)CC[C@@H](C)[[email protected]]4CC[[email protected]]3[[email protected]]2[C@@H]([C@@]1([C@@H](C[[email protected]](O)CC1)C[[email protected]]2O)C)C[[email protected]](O)[C@@]34C StdInChI InChI=1S/C26H45NO7S.Na/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29;/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34);/q;+1/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;/m1./s1 StdInChIKey JAJWGJBVLPIOOH-IZYKLYLVSA-M EINECS Number 205-653-7 MDL Number MFCD00150819 Molecular Formula C26H44NNaO7S·xH2O Molecular Weight 537.68 Properties Appearance Off-white to white powder Melting Point 230 ºC Solubility >250 G/L…