Catalog Number:
AG00EDWS
Chemical Name:
T Epitope, Threonyl
CAS Number:
60280-58-2
Molecular Formula:
C18H32N2O13
Molecular Weight:
484.4523
MDL Number:
MFCD02683396
IUPAC Name:
(2S,3R)-3-[(2S,3S,4R,5R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,3S,4S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-aminobutanoic acid
InChI:
InChI=1S/C18H32N2O13/c1-5(9(19)16(28)29)30-17-10(20-6(2)23)15(12(25)8(4-22)31-17)33-18-14(27)13(26)11(24)7(3-21)32-18/h5,7-15,17-18,21-22,24-27H,3-4,19H2,1-2H3,(H,20,23)(H,28,29)/t5-,7?,8?,9+,10+,11+,12+,13+,14+,15-,17+,18+/m1/s1
InChI Key:
VWNOCGQJSBAAFO-GUKJDGKFSA-N
SMILES:
OCC1O[C@H](O[C@@H]([C@@H](C(=O)O)N)C)[C@H]([C@H]([C@H]1O)O[C@@H]1OC(CO)[C@@H]([C@@H]([C@@H]1O)O)O)NC(=O)C
