Basic Information |
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Product Name: | SODIUM TAUROGLYCOCHOLATE |
CAS: | 11006-55-6 ;41945-48-6 |
English Synonyms: | TAUROGLYCOCHOLIC ACID SODIUM SALT ; SODIUM TAUROGLYCOCHOLATE |
MDL Number.: | MFCD00036243 |
H bond acceptor: | 10 |
H bond donor: | 5 |
Smile: | C[C@H](CCC(=O)NCC(=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.[Na+] |
InChi: | InChI=1S/C28H48N2O8S.Na/c1-16(4-7-24(34)30-15-25(35)29-10-11-39(36,37)38)19-5-6-20-26-21(14-23(33)28(19,20)3)27(2)9-8-18(31)12-17(27)13-22(26)32;/h16-23,26,31-33H,4-15H2,1-3H3,(H,29,35)(H,30,34)(H,36,37,38);/q;+1/p-1/t16-,17?,18-,19-,20+,21+,22-,23+,26+,27+,28-;/m1./s1 |
InChiKey: | InChIKey=PUODKHBECQMSKY-QZWBFCFVSA-M |
Property |
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Comments: | EINECS: 255-596-7 TSCA: N |
Safety information |
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