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[(2R,3S,4R,5R,6R)-5-azido-3-[(2R,3R,4S,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-azido-4,5-bis(phenylmethoxy)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-methoxycarbonyl-4-phenylmethoxy-3-sulfonatooxy-oxan-2-yl]oxy-6-[(2R,3S,4S,5R,6R)-2-methoxycarbonyl-4-phenylmethoxy-6-prop-2-enoxy-5-sulfonatooxy-oxan-3-yl]oxy-4-phenylmethoxy-oxan-2-yl]methyl sulfate; trimethylazanium

Systemtic Name:	[(2R,3S,4R,5R,6R)-5-azido-3-[(2R,3R,4S,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-azido-4,5-bis(phenylmethoxy)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-methoxycarbonyl-4-phenylmethoxy-3-sulfonatooxy-oxan-2-yl]oxy-6-[(2R,3S,4S,5R,6R)-2-methoxycarbonyl-4-phenylmethoxy-6-prop-2-enoxy-5-sulfonatooxy-oxan-3-yl]oxy-4-phenylmethoxy-oxan-2-yl]methyl sulfate; trimethylazanium
Openeye Name:	[(2R,3R,4S,5S,6R)-2-allyloxy-5-[(2R,3R,4R,5S,6R)-3-azido-5-[(2R,3R,4S,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-azido-4,5-dibenzyloxy-6-(sulfonatooxymethyl)tetrahydropyran-2-yl]oxy-4-benzyloxy-6-methoxycarbonyl-3-sulfonatooxy-tetrahydropyran-2-yl]oxy-4-benzyloxy-6-(sulfonatooxymethyl)tetrahydropyran-2-yl]oxy-4-benzyloxy-6-methoxycarbonyl-tetrahydropyran-3-yl] sulfate; trimethylammonium
CAS Name:	[(2R,3S,4R,5R,6R)-5-azido-3-[[(2R,3R,4S,5S,6R)-5-[[(2R,3R,4R,5S,6R)-3-azido-4,5-bis(phenylmethoxy)-6-(sulfonatooxymethyl)-2-oxanyl]oxy]-6-methoxycarbonyl-4-phenylmethoxy-3-sulfonatooxy-2-oxanyl]oxy]-6-[[(2R,3S,4S,5R,6R)-2-methoxycarbonyl-4-phenylmethoxy-6-prop-2-enoxy-5-sulfonatooxy-3-oxanyl]oxy]-4-phenylmethoxy-2-oxanyl]methyl sulfate; trimethylammonium
IUPAC Name:	[(2R,3S,4R,5R,6R)-5-azido-3-[(2R,3R,4S,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-azido-4,5-bis(phenylmethoxy)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-methoxycarbonyl-4-phenylmethoxy-3-sulfonatooxyoxan-2-yl]oxy-6-[(2R,3S,4S,5R,6R)-2-methoxycarbonyl-4-phenylmethoxy-6-prop-2-enoxy-5-sulfonatooxyoxan-3-yl]oxy-4-phenylmethoxyoxan-2-yl]methyl sulfate; trimethylazanium
Traditional Name:	[(2R,3R,4S,5S,6R)-2-allyloxy-5-[(2R,3R,4R,5S,6R)-3-azido-5-[(2R,3R,4S,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-azido-4,5-dibenzoxy-6-(sulfatomethyl)tetrahydropyran-2-yl]oxy-4-benzoxy-6-carbomethoxy-3-sulfato-tetrahydropyran-2-yl]oxy-4-benzoxy-6-(sulfatomethyl)tetrahydropyran-2-yl]oxy-4-benzoxy-6-carbomethoxy-tetrahydropyran-3-yl] sulfate; trimethylammonium
Formula:	C₇₆H₁₁₀N₁₀O₃₃S₄
MolecularWeight:	1819.9938

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C.C[NH+](C)C.C[NH+](C)C.C[NH+](C)C.COC(=O)C1C(C(C(C(O1)OCC=C)OS(=O)(=O)[O-])OCC2=CC=CC=C2)OC3C(C(C(C(O3)COS(=O)(=O)[O-])OC4C(C(C(C(O4)C(=O)OC)OC5C(C(C(C(O5)COS(=O)(=O)[O-])OCC6=CC=CC=C6)OCC7=CC=CC=C7)N=[N+]=[N-])OCC8=CC=CC=C8)OS(=O)(=O)[O-])OCC9=CC=CC=C9)N=[N+]=[N-]

Isomeric SMILES

C[NH+](C)C.C[NH+](C)C.C[NH+](C)C.C[NH+](C)C.COC(=O)[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OCC=C)OS(=O)(=O)[O-])OCC2=CC=CC=C2)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COS(=O)(=O)[O-])O[C@H]4[C@@H]([C@H]([C@@H]([C@@H](O4)C(=O)OC)O[C@@H]5[C@@H]([C@H]([C@@H]([C@H](O5)COS(=O)(=O)[O-])OCC6=CC=CC=C6)OCC7=CC=CC=C7)N=[N+]=[N-])OCC8=CC=CC=C8)OS(=O)(=O)[O-])OCC9=CC=CC=C9)N=[N+]=[N-]

InChI

InChI=1S/C64H74N6O33S4.4C3H9N/c1-4-30-87-63-57(102-106(79,80)81)51(91-34-41-26-16-8-17-27-41)53(55(100-63)59(71)85-2)98-62-46(68-70-66)50(90-33-40-24-14-7-15-25-40)48(44(96-62)37-94-105(76,77)78)97-64-58(103-107(82,83)84)52(92-35-42-28-18-9-19-29-42)54(56(101-64)60(72)86-3)99-61-45(67-69-65)49(89-32-39-22-12-6-13-23-39)47(43(95-61)36-93-104(73,74)75)88-31-38-20-10-5-11-21-38;4*1-4(2)3/h4-29,43-58,61-64H,1,30-37H2,2-3H3,(H,73,74,75)(H,76,77,78)(H,79,80,81)(H,82,83,84);4*1-3H3/t43-,44-,45-,46-,47-,48-,49-,50-,51+,52+,53+,54+,55-,56-,57-,58-,61-,62-,63-,64-;;;;/m1..../s1

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