.beta.-d-glucopyranoside, 3,6,9,12-tetraoxatridec-1-yl o-2,3,4,6-tetra-o-sulfo-.beta.-d-glucopyranosyl-(1->3)-o-2,4,6-tri-o-sulfo-.beta.-d-glucopyranosyl-(1->3)-o-2,4,6-tri-o-sulfo-.beta.d-glucopyranosyl-(1->3)-o-2,4,6-tri-o-sulfo-.beta.-d-glucopyranosyl-(1->3)-, 2,4,6-tris(hydrogen sulfate)

Structural Information

Molecular Formula

C₃₉H₇₀O₇₈S₁₆

SMILES

COCCOCCOCCOCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COS(=O)(=O)O)OS(=O)(=O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COS(=O)(=O)O)OS(=O)(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COS(=O)(=O)O)OS(=O)(=O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COS(=O)(=O)O)OS(=O)(=O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C39H70O78S16/c1-88-2-3-89-4-5-90-6-7-91-8-9-92-35-30(113-129(73,74)75)25(20(107-123(55,56)57)15(98-35)10-93-118(40,41)42)103-36-31(114-130(76,77)78)26(21(108-124(58,59)60)16(99-36)11-94-119(43,44)45)104-37-32(115-131(79,80)81)27(22(109-125(61,62)63)17(100-37)12-95-120(46,47)48)105-38-33(116-132(82,83)84)28(23(110-126(64,65)66)18(101-38)13-96-121(49,50)51)106-39-34(117-133(85,86)87)29(112-128(70,71)72)24(111-127(67,68)69)19(102-39)14-97-122(52,53)54/h15-39H,2-14H2,1H3,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75)(H,76,77,78)(H,79,80,81)(H,82,83,84)(H,85,86,87)/t15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+,26+,27+,28+,29+,30-,31-,32-,33-,34-,35-,36+,37+,38+,39+/m1/s1

InChIKey

OBHWFMBCBBOGAW-QXTNJXOQSA-N

Compound name

[(2R,3R,4S,5R,6R)-4-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4S,5R,6R)-3,5-disulfooxy-6-(sulfooxymethyl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-disulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxy-3,5-disulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxy-6-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-3,5-disulfooxyoxan-2-yl]methyl hydrogen sulfate

Related CIDs

• CID 481634