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CHEBI:153763 - CID 71297998

ChEBI IDCHEBI:153763
ChEBI NameCID 71297998
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC96H160N6O71
Net Charge0
Average Mass2534.307
Monoisotopic Mass2532.90939
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[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]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=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@H](O[C@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[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@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/6,14,13/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][a2112h-1a_1-5]/1-2-3-4-2-5-2-5-6-2-4-2-5-6/a4-b1_b4-c1_c3-d1_c4-j1_c6-k1_d2-e1_d4-g1_e4-f1_g4-h1_h4-i1_k2-l1_l4-m1_m4-n1
InChIInChI=1S/C96H160N6O71/c1-21(116)97-41-53(128)71(32(12-108)148-83(41)146)162-85-43(99-23(3)118)55(130)75(36(16-112)154-85)167-94-70(145)80(79(170-84-42(98-22(2)117)52(127)47(122)27(7-103)149-84)40(161-94)20-147-95-81(61(136)51(126)31(11-107)153-95)172-87-45(101-25(5)120)56(131)74(35(15-111)156-87)166-93-68(143)63(138)77(38(18-114)159-93)169-91-66(141)60(135)50(125)30(10-106)152-91)171-96-82(173-88-46(102-26(6)121)57(132)72(34(14-110)157-88)164-89-64(139)58(133)48(123)28(8-104)150-89)69(144)78(39(19-115)160-96)163-86-44(100-24(4)119)54(129)73(33(13-109)155-86)165-92-67(142)62(137)76(37(17-113)158-92)168-90-65(140)59(134)49(124)29(9-105)151-90/h27-96,103-115,122-146H,7-20H2,1-6H3,(H,97,116)(H,98,117)(H,99,118)(H,100,119)(H,101,120)(H,102,121)/t27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,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-/m1/s1
InChIKeyMXDYSJLREJEWMV-XHMCFSCSSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 71297998 (CHEBI:153763) is a polysaccharide (CHEBI:18154)
Synonyms  Source
alpha-D-galacto-hexopyranosyl-(1->4)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)]-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-galacto-hexopyranosyl-(1->4)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)][2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
Gal(a1-4)Gal(b1-4)GlcNAc(b1-4)[Gal(b1-4)GlcNAc(b1-2)]Man(a1-3)[Gal(a1-4)Gal(b1-4)GlcNAc(b1-2)Man(a1-6)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)GlcNAcSUBMITTER
Manual XrefsDatabases
G77467SIGlyGen
G77467SIGlyTouCan