1β-Hydroxyglycodeoxycholic Acid-[d5]

General Information
Catalog: BLP-006582
Molecular Formula: C26H39D5NO6
Molecular Weight: 470.70
Synonyms 1β-Hydroxyglycodeoxycholic Acid-D4; 1beta-Hydroxyglycodeoxycholic Acid-D4
IUPAC Name 2-[[(4R)-4-[(1R,3S,5R,10S,12S,13R,17R)-2,2,3,4,4-pentadeuterio-1,3,12-trihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid
Canonical SMILES CC(CCC(=O)NCC(=O)O)C1CCC2C1(C(CC3C2CCC4C3(C(CC(C4)O)O)C)O)C
InChI InChI=1S/C26H43NO6/c1-14(4-9-23(31)27-13-24(32)33)18-7-8-19-17-6-5-15-10-16(28)11-21(29)25(15,2)20(17)12-22(30)26(18,19)3/h14-22,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15-,16+,17?,18-,19?,20?,21-,22+,25+,26-/m1/s1/i10D2,11D2,16D
InChI Key OBPHLBLJRYFXIZ-GNPILSABSA-N
Purity >95% by NMR; >98% atom D
Solubility Soluble in DMSO
Appearance White Solid
Storage Store at -20°C

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