CHEBI:146917 - CID 91860167

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name CID 91860167
ChEBI ID CHEBI:146917
Stars This entity has been manually annotated by a third party.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
Formula C140H230N10O102
Net Charge 0
Average Mass 3685.348
Monoisotopic Mass 3683.31179
InChI InChI=1S/C140H230N10O102/c1-34-76(184)93(201)96(204)125(223-34)219-30-54(183)103(77(185)45(16-151)141-35(2)165)236-121-72(147-41(8)171)89(197)106(60(26-161)228-121)239-127-99(207)114(243-132-119(245-124-75(150-44(11)174)91(199)105(59(25-160)231-124)238-126-97(205)94(202)82(190)66(234-126)33-222-137(133(211)212)12-46(175)67(142-36(3)166)110(246-137)78(186)50(179)17-152)98(206)109(63(29-164)232-132)237-122-73(148-42(9)172)90(198)107(61(27-162)229-122)241-129-101(209)116(85(193)56(22-157)225-129)251-139(135(215)216)14-48(177)69(144-38(5)168)112(248-139)80(188)52(181)19-154)87(195)65(233-127)32-221-131-118(244-123-74(149-43(10)173)92(200)108(62(28-163)230-123)242-130-102(210)117(86(194)57(23-158)226-130)252-140(136(217)218)15-49(178)70(145-39(6)169)113(249-140)81(189)53(182)20-155)95(203)83(191)64(235-131)31-220-120-71(146-40(7)170)88(196)104(58(24-159)227-120)240-128-100(208)115(84(192)55(21-156)224-128)250-138(134(213)214)13-47(176)68(143-37(4)167)111(247-138)79(187)51(180)18-153/h34,45-132,151-164,175-210H,12-33H2,1-11H3,(H,141,165)(H,142,166)(H,143,167)(H,144,168)(H,145,169)(H,146,170)(H,147,171)(H,148,172)(H,149,173)(H,150,174)(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
InChIKey LNNRSYOISAKWPS-UVWIXWKESA-N
SMILES O([C@H]1O[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O[C@]4(O[C@H]([C@H](NC(=O)C)[C@@H](O)C4)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]3O)CO)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O)[C@@H]1O[C@@H]5O[C@@H]([C@@H](O[C@@H]6O[C@@H]([C@H](O)[C@H](O)[C@H]6O)CO[C@]7(O[C@H]([C@H](NC(=O)C)[C@@H](O)C7)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]5NC(=O)C)CO)CO)[C@H]8[C@H](O)[C@H](O[C@@H](O[C@H]9[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]9CO)O[C@@H]([C@H](O)[C@@H](NC(=O)C)CO)[C@H](O)CO[C@@H]%10O[C@H]([C@@H](O)[C@@H](O)[C@@H]%10O)C)[C@H]8O)CO[C@H]%11O[C@@H]([C@@H](O)[C@H](O)[C@@H]%11O[C@@H]%12O[C@@H]([C@@H](O[C@@H]%13O[C@@H]([C@H](O)[C@H](O[C@]%14(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%14)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%13O)CO)[C@H](O)[C@H]%12NC(=O)C)CO)CO[C@@H]%15O[C@@H]([C@@H](O[C@@H]%16O[C@@H]([C@H](O)[C@H](O[C@]%17(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%17)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%16O)CO)[C@H](O)[C@H]%15NC(=O)C)CO
ChEBI Ontology
Outgoing CID 91860167 (CHEBI:146917) is a polysaccharide (CHEBI:18154)
Synonym Source
WURCS=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_i3-j2_k2-l1_k6-o1_l4-m1_m3-n2_o4-p1_p3-q2 SUBMITTER
Manual Xrefs Databases
G06059DJ GlyGen
G06059DJ GlyTouCan
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