Name | N-[(3alpha,5beta,7alpha,8xi,12alpha)-3,12-Dihydroxy-24-oxo-7-(sulfooxy)cholan-24-yl]glycine |
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Synonyms | N-[(3a,5b |
Molecular Structure | ![]() |
Molecular Formula | C26H43NO9S |
Molecular Weight | 545.69 |
CAS Registry Number | 71977-73-6 |
SMILES | OC(=O)CNC(=O)CC[C@@H](C)[C@H]3CC[C@H]2[C@@H]4[C@H](OS(O)(=O)=O)C[C@@H]1C[C@H](O)CC[C@]1(C)[C@H]4C[C@H](O)[C@@]23C |
InChI | 1S/C26H43NO9S/c1-14(4-7-22(30)27-13-23(31)32)17-5-6-18-24-19(12-21(29)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)36-37(33,34)35/h14-21,24,28-29H,4-13H2,1-3H3,(H,27,30)(H,31,32)(H,33,34,35)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1 |
InChIKey | BJPPZTDOLXZUSK-FRVQLJSFSA-N |
Density | 1.361g/cm3 (Cal.) |
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Market Analysis Reports |
List of Reports Available for N-[(3alpha,5beta,7alpha,8xi,12alpha)-3,12-Dihydroxy-24-oxo-7-(sulfooxy)cholan-24-yl]glycine |