Catalog Number:
AG002WY5
Chemical Name:
β-D-Glucopyranosiduronic acid, 6-[[2-[4-[(2,4-dioxo-5-thiazolidinyl)methyl]phenoxy]ethyl]methylamino]-3-pyridinyl
CAS Number:
288853-59-8
Molecular Formula:
C24H27N3O10S
Molecular Weight:
549.5503
MDL Number:
MFCD09840772
IUPAC Name:
(3R,6S)-6-[6-[2-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]ethyl-methylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI:
InChI=1S/C24H27N3O10S/c1-27(8-9-35-13-4-2-12(3-5-13)10-15-21(31)26-24(34)38-15)16-7-6-14(11-25-16)36-23-19(30)17(28)18(29)20(37-23)22(32)33/h2-7,11,15,17-20,23,28-30H,8-10H2,1H3,(H,32,33)(H,26,31,34)/t15?,17?,18-,19?,20?,23-/m1/s1
InChI Key:
QGESYIGEZXWVIN-MEWUKIKYSA-N
SMILES:
O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccc(cn1)O[C@@H]1O[C@H](C(=O)O)[C@H]([C@@H]([C@H]1O)O)O)C
