CHEBI:155083 - CID 91853991

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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 91853991
ChEBI ID CHEBI:155083
Stars This entity has been manually annotated by a third party.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
Formula C146H238N10O106
Net Charge 0
Average Mass 3829.474
Monoisotopic Mass 3827.35405
InChI InChI=1S/C146H238N10O106/c1-34-77(189)92(204)96(208)130(229-34)252-117-75(155-44(11)179)128(237-62(29-169)111(117)250-135-103(215)120(85(197)54(21-161)232-135)261-145(141(222)223)15-48(183)69(149-38(5)173)115(259-145)81(193)52(187)19-159)245-109-60(27-167)239-137(122(100(109)212)255-126-73(153-42(9)177)90(202)106(57(24-164)235-126)247-132-98(210)94(206)83(195)65(242-132)32-227-143(139(218)219)13-46(181)67(147-36(3)171)113(257-143)79(191)50(185)17-157)226-31-64-87(199)119(102(214)134(241-64)249-108-59(26-166)234-125(72(89(108)201)152-41(8)176)244-105-56(23-163)231-124(217)71(88(105)200)151-40(7)175)254-138-123(256-127-74(154-43(10)178)91(203)107(58(25-165)236-127)248-133-99(211)95(207)84(196)66(243-133)33-228-144(140(220)221)14-47(182)68(148-37(4)172)114(258-144)80(192)51(186)18-158)101(213)110(61(28-168)240-138)246-129-76(156-45(12)180)118(253-131-97(209)93(205)78(190)35(2)230-131)112(63(30-170)238-129)251-136-104(216)121(86(198)55(22-162)233-136)262-146(142(224)225)16-49(184)70(150-39(6)174)116(260-146)82(194)53(188)20-160/h34-35,46-138,157-170,181-217H,13-33H2,1-12H3,(H,147,171)(H,148,172)(H,149,173)(H,150,174)(H,151,175)(H,152,176)(H,153,177)(H,154,178)(H,155,179)(H,156,180)(H,218,219)(H,220,221)(H,222,223)(H,224,225)/t34-,35-,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+,133+,134+,135+,136+,137+,138-,143-,144-,145+,146+/m1/s1
InChIKey QMENBJRCSLREIK-IZVIAEBYSA-N
SMILES O([C@H]1[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO[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](O)[C@H]2NC(=O)C)CO)[C@H](O[C@@H]1CO)O[C@H]5[C@H](O)[C@H](O[C@@H](O[C@H]6[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]6CO)O[C@H]7[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]7CO)O)[C@H]5O)CO[C@H]8O[C@@H]([C@@H](O[C@@H]9O[C@@H]([C@@H](O[C@@H]%10O[C@@H]([C@H](O)[C@H](O[C@]%11(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%11)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%10O)CO)[C@H](O[C@H]%12O[C@@H]([C@H](O)[C@H](O)[C@H]%12O)C)[C@H]9NC(=O)C)CO)[C@H](O)[C@@H]8O[C@@H]%13O[C@@H]([C@@H](O[C@@H]%14O[C@@H]([C@H](O)[C@H](O)[C@H]%14O)CO[C@]%15(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%15)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]%13NC(=O)C)CO)CO)[C@@H]%16O[C@@H]([C@@H](O[C@@H]%17O[C@@H]([C@H](O)[C@H](O[C@]%18(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%18)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%17O)CO)[C@H](O[C@H]%19O[C@@H]([C@H](O)[C@H](O)[C@H]%19O)C)[C@H]%16NC(=O)C)CO
ChEBI Ontology
Outgoing CID 91853991 (CHEBI:155083) is a polysaccharide (CHEBI:18154)
Synonyms Sources
5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-D-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-D-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose SUBMITTER
NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)[D-Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-3)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)[D-Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)b-GlcNAc SUBMITTER
WURCS=2.0/6,19,18/[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][a2112m-1a_1-5]/1-1-2-3-1-4-5-1-6-4-5-3-1-4-5-1-6-4-5/a4-b1_b4-c1_c3-d1_c6-l1_d2-e1_d4-h1_e4-f1_f6-g2_h3-i1_h4-j1_j3-k2_l2-m1_l4-p1_m4-n1_n6-o2_p3-q1_p4-r1_r3-s2 SUBMITTER
Manual Xrefs Databases
G97039HI GlyGen
G97039HI GlyTouCan
View more database links