SODIUM TAUROCHOLATE DIHYDRATE

CAS No.
345909-26-4
CCD No.
CCD08021640
Formula
C26 H44 N O7 S . Na . 2 H2 O
MolWeight
573.719

Basic Information

Product Name: SODIUM TAUROCHOLATE DIHYDRATE
CAS: 345909-26-4
English Synonyms: TAUROCHOLIC ACID SODIUM SALT HYDRATE > 95 % ; SODIUM TAUROCHOLATE DIHYDRATE
MDL Number.: MFCD00150132
H bond acceptor: 8
H bond donor: 4
Smile: C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](CC4[C@@]3(CC[C@H](C4)O)C)O)O)C.O.O.[Na+]
InChi: InChI=1S/C26H45NO7S.Na.2H2O/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);;2*1H2/q;+1;;/p-1/t15-,16?,17-,18-,19+,20+,21-,22+,24+,25+,26-;;;/m1.../s1
InChiKey: InChIKey=GYRLGILDCKQBJF-SSGBDSDUSA-M

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