Analyte Name

Glucosamine-AEEA linker-chelator(DOTAM)

Molecular Formula

C68 H125 N17 O24

Molecular Weight

1564.82

Accurate Mass

1563.908

SMILES

CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1NCCCCCCNC(=O)COCCOCCNC(=O)CC(CC(=O)NCCOCCOCC(=O)NCCCCCC(=O)N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(=O)C)NC(=O)CCCCCCNC(=O)CN3CCN(CC(=O)N)CCN(CC(=O)N)CCN(CC(=O)N)CC3

InChI

InChI=1S/C68H125N17O24/c1-46(88)78-61-65(102)63(100)49(42-86)108-67(61)77-19-12-6-5-11-17-73-59(98)44-106-34-32-104-30-20-75-56(95)36-48(37-57(96)76-21-31-105-33-35-107-45-60(99)74-18-13-7-9-15-55(94)81-68-62(79-47(2)89)66(103)64(101)50(43-87)109-68)80-54(93)14-8-3-4-10-16-72-58(97)41-85-28-26-83(39-52(70)91)24-22-82(38-51(69)90)23-25-84(27-29-85)40-53(71)92/h48-50,61-68,77,86-87,100-103H,3-45H2,1-2H3,(H2,69,90)(H2,70,91)(H2,71,92)(H,72,97)(H,73,98)(H,74,99)(H,75,95)(H,76,96)(H,78,88)(H,79,89)(H,80,93)(H,81,94)/t48?,49-,50-,61-,62-,63-,64-,65-,66-,67-,68-/m1/s1

IUPAC

N-[2-[2-[2-[6-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]hexylamino]-2-oxoethoxy]ethoxy]ethyl]-N'-[2-[2-[2-[[6-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-6-oxohexyl]amino]-2-oxoethoxy]ethoxy]ethyl]-3-[7-[[2-[4,7,10-tris(2-amino-2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]heptanoylamino]pentanediamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat