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CHEBI:151099 - CID 91857665

ChEBI IDCHEBI:151099
ChEBI NameCID 91857665
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC140H230N10O102
Net Charge0
Average Mass3685.348
Monoisotopic Mass3683.31179
SMILESCC(=O)N[C@H]1[C@H](O[C@@H]([C@H](O)[C@H](CO)NC(C)=O)[C@H](O)CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO[C@]6(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO[C@]6(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/7,18,17/[h2122h_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-2-3-4-2-5-6-2-5-6-4-2-5-6-2-5-6-7/a4-b1_a6-r1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e4-f1_f6-g2_h4-i1_i6-j2_k2-l1_k6-o1_l4-m1_m3-n2_o4-p1_p6-q2
InChIInChI=1S/C140H230N10O102/c1-34-76(182)93(199)98(204)125(225-34)219-28-54(181)105(77(183)45(16-151)141-35(2)163)238-121-72(147-41(8)169)89(195)109(59(25-160)228-121)243-129-103(209)116(245-132-119(247-124-75(150-44(11)172)91(197)108(58(24-159)231-124)242-128-101(207)96(202)84(190)66(236-128)33-224-139(135(215)216)14-48(175)69(144-38(5)166)114(250-139)80(186)52(179)19-154)102(208)111(61(27-162)232-132)239-122-73(148-42(9)170)90(196)107(57(23-158)229-122)241-127-100(206)95(201)83(189)65(235-127)32-223-138(134(213)214)13-47(174)68(143-37(4)165)113(249-138)79(185)51(178)18-153)87(193)63(233-129)30-221-131-118(246-123-74(149-43(10)171)92(198)110(60(26-161)230-123)244-130-104(210)117(86(192)55(21-156)226-130)252-140(136(217)218)15-49(176)70(145-39(6)167)115(251-140)81(187)53(180)20-155)97(203)85(191)62(237-131)29-220-120-71(146-40(7)168)88(194)106(56(22-157)227-120)240-126-99(205)94(200)82(188)64(234-126)31-222-137(133(211)212)12-46(173)67(142-36(3)164)112(248-137)78(184)50(177)17-152/h34,45-132,151-162,173-210H,12-33H2,1-11H3,(H,141,163)(H,142,164)(H,143,165)(H,144,166)(H,145,167)(H,146,168)(H,147,169)(H,148,170)(H,149,171)(H,150,172)(H,211,212)(H,213,214)(H,215,216)(H,217,218)/t34-,45-,46-,47-,48-,49-,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,70+,71+,72+,73+,74+,75+,76+,77+,78+,79+,80+,81+,82-,83-,84-,85+,86-,87+,88+,89+,90+,91+,92+,93+,94-,95-,96-,97-,98-,99+,100+,101+,102-,103-,104+,105+,106+,107+,108+,109+,110+,111+,112+,113+,114+,115+,116-,117-,118-,119-,120+,121-,122-,123-,124-,125+,126-,127-,128-,129-,130-,131-,132+,137+,138+,139+,140-/m0/s1
InChIKeyGNVKJHAAMRVZCB-FUINTKCTSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91857665 (CHEBI:151099) is a polysaccharide (CHEBI:18154)
Manual XrefsDatabases
G46103YXGlyGen
G46103YXGlyTouCan