InChI=1S/C22H40N2O19S/c1- 7(28) 23- 9(3- 25) 19(14(31) 10(30) 4- 26) 42- 21- 13(24- 8(2) 29) 20(16(33) 12(41- 21) 6- 39- 44(36,37) 38) 43- 22- 18(35) 17(34) 15(32) 11(5- 27) 40- 22/h9- 22,25- 27,30- 35H,3- 6H2,1- 2H3,(H,23,28) (H,24,29) (H,36,37,38) /t9- ,10+,11+,12+,13+,14- ,15- ,16+,17- ,18+,19+,20+,21- ,22- /m0/s1 |
JUBHPHIHWKWRQX-MRCIVFNLSA-N |
O([C@@H] 1[C@@H] (NC(=O) C) [C@@H] (O[C@@H] ([C@H] 1O) COS(O) (=O) =O) O[C@H] ([C@@H] (NC(=O) C) CO) [C@@H] (O) [C@H] (O) CO) [C@@H] 2O[C@@H] ([C@H] (O) [C@H] (O) [C@H] 2O) CO |
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β- D- galactopyranosyl- (1→3)- 2- acetamido- 2- deoxy- 6- O- sulfo- β- D- glucopyranosyl- (1→3)- 2- acetamido- 2- deoxy- D- galactitol
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[(2R,3S,4R,5R,6R)- 5- acetamido- 6- [(2S,3R,4S,5R)- 2- acetamido- 1,4,5,6- tetrahydroxyhexan- 3- yl]oxy- 3- hydroxy- 4- [(2R,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]methyl hydrogen sulfate
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IUPAC
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WURCS=2.0/3,3,2/[h2112h_2*NCC/3=O][a2122h- 1b_1- 5_2*NCC/3=O_6*OSO/3=O/3=O][a2112h- 1b_1- 5]/1- 2- 3/a3- b1_b3- c1
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SUBMITTER
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