Catalog Number:
AG000VUT
Chemical Name:
L-glycero-α-D-manno-Heptopyranoside, methyl O-α-D-glucopyranosyl-(1→3)-O-[L-glycero-α-D-manno-heptopyranosyl-(1→7)]- (9CI)
CAS Number:
131289-51-5
Molecular Formula:
C21H38O18
Molecular Weight:
578.5156
IUPAC Name:
(2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3-[(2S,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2,5-dihydroxy-2-methyloxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C21H38O18/c1-21(34)18(38-20-13(32)10(29)11(30)15(36-20)5(25)2-22)17(14(33)16(39-21)6(26)3-23)37-19-12(31)9(28)8(27)7(4-24)35-19/h5-20,22-34H,2-4H2,1H3/t5-,6-,7-,8-,9+,10+,11+,12-,13+,14-,15-,16-,17+,18+,19-,20+,21-/m1/s1
InChI Key:
YZEOCOYTQXUPSU-JARXOOGZSA-N
SMILES:
OC[C@H]([C@H]1O[C@@](C)(O)[C@H]([C@H]([C@@H]1O)O[C@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O[C@@H]1O[C@H]([C@@H](CO)O)[C@@H]([C@@H]([C@@H]1O)O)O)O