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CHEBI:154835 - CID 91854395

ChEBI IDCHEBI:154835
ChEBI NameCID 91854395
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC109H178N8O83
Net Charge0
Average Mass2928.596
Monoisotopic Mass2926.99536
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](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@]6(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O6)[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@]7(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O7)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[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@]6(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O6)[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)O[C@H]1O
WURCSWURCS=2.0/5,14,13/[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*NCCO/3=O]/1-1-2-3-1-4-5-1-4-5-3-1-4-5/a4-b1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e4-f1_f3-g2_h4-i1_i6-j2_k2-l1_l4-m1_m3-n2
InChIInChI=1S/C109H178N8O83/c1-26(133)110-54-67(155)79(40(15-124)176-93(54)167)187-94-55(111-27(2)134)69(157)81(42(17-126)180-94)190-99-76(164)88(66(154)46(185-99)24-174-102-91(73(161)62(150)37(12-121)179-102)194-96-57(113-29(4)136)70(158)82(43(18-127)182-96)191-100-77(165)89(64(152)38(13-122)177-100)199-108(105(170)171)7-32(139)52(116-49(145)22-131)86(197-108)60(148)35(142)10-119)193-103-92(195-97-58(114-30(5)137)71(159)83(44(19-128)183-97)192-101-78(166)90(65(153)39(14-123)178-101)200-109(106(172)173)8-33(140)53(117-50(146)23-132)87(198-109)61(149)36(143)11-120)75(163)84(45(20-129)184-103)188-95-56(112-28(3)135)68(156)80(41(16-125)181-95)189-98-74(162)72(160)63(151)47(186-98)25-175-107(104(168)169)6-31(138)51(115-48(144)21-130)85(196-107)59(147)34(141)9-118/h31-47,51-103,118-132,138-143,147-167H,6-25H2,1-5H3,(H,110,133)(H,111,134)(H,112,135)(H,113,136)(H,114,137)(H,115,144)(H,116,145)(H,117,146)(H,168,169)(H,170,171)(H,172,173)/t31-,32-,33-,34+,35+,36+,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47+,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+,107+,108-,109-/m0/s1
InChIKeyVPSBQPDGUMLUBI-HPIDIDBMSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91854395 (CHEBI:154835) is a polysaccharide (CHEBI:18154)
Synonyms  Source
3,5-dideoxy-5-glycolamido-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[3,5-dideoxy-5-glycolamido-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->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[3,5-dideoxy-5-glycolamido-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-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-hexopyranoseSUBMITTER
NeuGc(a2-3)Gal(b1-4)GlcNAc(b1-2)[NeuGc(a2-6)Gal(b1-4)GlcNAc(b1-4)]Man(a1-3)[NeuGc(a2-3)Gal(b1-4)GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)b-GlcNAcSUBMITTER
Manual XrefsDatabases
G90509QWGlyGen
G90509QWGlyTouCan