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2-[[(3alpha,5beta)-24-oxo-3-(sulfooxy)cholan-24-yl]amino]-ethanesulfonic acid
For research use only. Not for therapeutic Use.
Catalog Number | M082014 |
CAS Number | 15324-65-9 |
Molecular Formula | C26H45NO8S2 |
Purity | ≥95% |
Storage | Room temperature |
IUPAC Name | 2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-sulfooxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid |
InChI | InChI=1S/C26H45NO8S2/c1-17(4-9-24(28)27-14-15-36(29,30)31)21-7-8-22-20-6-5-18-16-19(35-37(32,33)34)10-12-25(18,2)23(20)11-13-26(21,22)3/h17-23H,4-16H2,1-3H3,(H,27,28)(H,29,30,31)(H,32,33,34)/t17-,18-,19-,20+,21-,22+,23+,25+,26-/m1/s1 |
InChIKey | HSNPMXROZIQAQD-GBURMNQMSA-N |
SMILES | CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OS(=O)(=O)O)C)C |