Glycoursodeoxycholic acid
Catalog Number | BL-M000501 |
CAS Number | 64480-66-6 |
Description | Glycoursodeoxycholic Acid is a metabolite of Ursodeoxycholic Acid. Ursodeoxycholic Acid is one of metabolites of intestinal bacteria. Ursodeoxycholic Acid shows an effect of apoptosis suppression and reduction in gallstone formation. |
IUPAC Name | 2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid |
Synonyms | Ursodeoxycholylglycine; GUDCA; Glycine ursodeoxycholic acid; N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)-glycine; N-[(3α,5β,7β)-3,7-dihydroxy-24-oxocholan-24-yl]-glycine |
Molecular Weight | 449.63 |
Molecular Formula | C26H43NO5 |
Melting Point | 223-225°C (dec.) |
Purity | >99% |
Solubility | Soluble in DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly) |
Appearance | White to Off-White Solid |
Shelf Life | 1 Year |
Storage | Store at -20°C |
Percent Composition | C 69.45%, H 9.64%, N 3.12%, O 17.79% |
Canonical SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C |
InChI | InChI=1S/C26H43NO5/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16+,17-,18-,19+,20+,21+,24+,25+,26-/m1/s1 |
InChI Key | GHCZAUBVMUEKKP-XROMFQGDSA-N |
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