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CHEBI:153953 - CID 91851418

ChEBI IDCHEBI:153953
ChEBI NameCID 91851418
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC249H411N15O178
Net Charge0
Average Mass6462.954
Monoisotopic Mass6459.35700
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O[C@@H]%10O[C@H](CO)[C@H](O)[C@H](O)[C@H]%10O)[C@H](O[C@@H]%10O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]%10O)[C@H]9NC(C)=O)[C@H]8O)[C@H](O[C@@H]8O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]8O)[C@H]7NC(C)=O)[C@H]6O)[C@H](O)[C@H]5NC(C)=O)[C@@H](O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O[C@@H]9O[C@H](CO)[C@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8NC(C)=O)[C@H]7O)[C@H](O)[C@H]6NC(C)=O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O[C@@H]%10O[C@H](CO)[C@H](O)[C@H](O)[C@H]%10O)[C@H](O[C@@H]%10O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]%10O)[C@H]9NC(C)=O)[C@H]8O)[C@H](O[C@@H]8O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]8O)[C@H]7NC(C)=O)[C@H]6O)[C@H](O[C@@H]6O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]6O)[C@H]5NC(C)=O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O[C@@H]9O[C@H](CO[C@]%10(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O%10)[C@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8NC(C)=O)[C@H]7O)[C@H](O)[C@H]6NC(C)=O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H]1O
WURCSWURCS=2.0/6,36,35/[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]/1-1-2-3-1-4-1-4-1-4-5-1-6-4-1-6-4-1-6-4-3-1-4-1-4-1-4-1-4-1-6-4-1-6-4-6/a4-b1_a6-J1_b4-c1_c3-d1_c6-u1_d2-e1_d4-l1_e4-f1_f3-g1_g4-h1_h3-i1_i4-j1_j6-k2_l3-m1_l4-n1_n3-o1_o3-p1_o4-q1_q3-r1_r3-s1_r4-t1_u2-v1_u6-B1_v4-w1_w3-x1_x4-y1_y3-z1_z4-A1_B4-C1_C3-D1_D3-E1_D4-F1_F3-G1_G3-H1_G4-I1
InChIInChI=1S/C249H411N15O178/c1-53-120(308)150(338)161(349)227(376-53)373-51-104-190(141(329)106(213(369)382-104)251-60(8)292)412-215-108(253-62(10)294)143(331)188(90(38-280)395-215)420-245-180(368)210(140(328)102(408-245)50-374-246-211(440-220-113(258-67(15)299)148(336)186(93(41-283)400-220)418-239-174(362)204(134(322)81(29-271)388-239)433-218-111(256-65(13)297)146(334)184(91(39-281)398-218)416-237-172(360)202(132(320)79(27-269)386-237)431-216-109(254-63(11)295)144(332)182(88(36-278)396-216)413-233-167(355)156(344)127(315)76(24-266)383-233)160(348)131(319)101(410-246)49-372-214-107(252-61(9)293)142(330)181(87(35-277)394-214)415-241-176(364)206(136(324)83(31-273)390-241)435-225-118(263-72(20)304)200(429-231-165(353)154(342)124(312)57(5)380-231)194(99(47-289)405-225)424-243-178(366)207(137(325)85(33-275)392-243)436-223-116(261-70(18)302)198(427-229-163(351)152(340)122(310)55(3)378-229)191(96(44-286)403-223)421-234-168(356)157(345)128(316)77(25-267)384-234)439-247-212(441-221-114(259-68(16)300)149(337)187(94(42-284)401-221)419-240-175(363)205(135(323)82(30-272)389-240)434-219-112(257-66(14)298)147(335)185(92(40-282)399-219)417-238-173(361)203(133(321)80(28-270)387-238)432-217-110(255-64(12)296)145(333)183(89(37-279)397-217)414-236-170(358)159(347)130(318)103(409-236)52-375-249(248(370)371)22-74(306)105(250-59(7)291)196(442-249)126(314)75(307)23-265)171(359)189(95(43-285)407-247)411-222-115(260-69(17)301)197(426-228-162(350)151(339)121(309)54(2)377-228)193(98(46-288)402-222)423-242-177(365)209(139(327)84(32-274)391-242)438-226-119(264-73(21)305)201(430-232-166(354)155(343)125(313)58(6)381-232)195(100(48-290)406-226)425-244-179(367)208(138(326)86(34-276)393-244)437-224-117(262-71(19)303)199(428-230-164(352)153(341)123(311)56(4)379-230)192(97(45-287)404-224)422-235-169(357)158(346)129(317)78(26-268)385-235/h53-58,74-247,265-290,306-369H,22-52H2,1-21H3,(H,250,291)(H,251,292)(H,252,293)(H,253,294)(H,254,295)(H,255,296)(H,256,297)(H,257,298)(H,258,299)(H,259,300)(H,260,301)(H,261,302)(H,262,303)(H,263,304)(H,264,305)(H,370,371)/t53-,54-,55-,56-,57-,58-,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-,139-,140+,141+,142+,143+,144+,145+,146+,147+,148+,149+,150+,151+,152+,153+,154+,155+,156-,157-,158-,159-,160-,161-,162-,163-,164-,165-,166-,167+,168+,169+,170+,171-,172+,173+,174+,175+,176+,177+,178+,179+,180-,181+,182+,183+,184+,185+,186+,187+,188+,189+,190+,191+,192+,193+,194+,195+,196+,197+,198+,199+,200+,201+,202-,203-,204-,205-,206-,207-,208-,209-,210-,211-,212-,213+,214+,215-,216-,217-,218-,219-,220-,221-,222-,223-,224-,225-,226-,227+,228-,229-,230-,231-,232-,233-,234-,235-,236-,237-,238-,239-,240-,241-,242-,243-,244-,245-,246-,247+,249+/m0/s1
InChIKeyGHAJCDXOICEEGD-MGOZHNFHSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91851418 (CHEBI:153953) is a polysaccharide (CHEBI:18154)
Synonyms  Source
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->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranoseSUBMITTER
NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-3)[Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]b-GlcNAcSUBMITTER
Manual XrefsDatabases
G81096RMGlyTouCan
G81096RMGlyGen