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CHEBI:147122 - CID 71297613

ChEBI IDCHEBI:147122
ChEBI NameCID 71297613
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC102H169N9O70
Net Charge0
Average Mass2641.467
Monoisotopic Mass2639.99412
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[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H](O)[C@H]4NC(C)=O)[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](O)[C@H]4NC(C)=O)[C@H](O)[C@H]3NC(C)=O)[C@@H](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](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]4NC(C)=O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/7,14,13/[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_2*NCC/3=O][a2112h-1b_1-5][a1221m-1a_1-5]/1-2-3-4-2-5-2-6-4-2-5-2-5-7/a4-b1_a6-n1_b4-c1_c3-d1_c6-i1_d2-e1_d4-g1_e4-f1_g4-h1_i2-j1_i6-l1_j4-k1_l4-m1
InChIInChI=1S/C102H169N9O70/c1-24-56(131)72(147)75(150)98(158-24)156-23-46-85(66(141)47(89(154)159-46)103-25(2)122)176-95-53(109-31(8)128)71(146)83(42(19-120)166-95)178-100-78(153)86(179-102-88(181-97-55(111-33(10)130)69(144)81(40(17-118)168-97)174-93-50(106-28(5)125)65(140)59(134)36(13-114)162-93)77(152)84(43(20-121)169-102)175-94-52(108-30(7)127)70(145)82(41(18-119)165-94)177-99-76(151)73(148)60(135)37(14-115)163-99)62(137)45(170-100)22-157-101-87(180-96-54(110-32(9)129)68(143)80(39(16-117)167-96)173-92-49(105-27(4)124)64(139)58(133)35(12-113)161-92)74(149)61(136)44(171-101)21-155-90-51(107-29(6)126)67(142)79(38(15-116)164-90)172-91-48(104-26(3)123)63(138)57(132)34(11-112)160-91/h24,34-102,112-121,131-154H,11-23H2,1-10H3,(H,103,122)(H,104,123)(H,105,124)(H,106,125)(H,107,126)(H,108,127)(H,109,128)(H,110,129)(H,111,130)/t24-,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-,97-,98+,99-,100-,101-,102+/m0/s1
InChIKeyDAXOZVJJGXJYIN-ZPSKMIQZSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 71297613 (CHEBI:147122) is a polysaccharide (CHEBI:18154)
Synonyms  Source
2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[2-acetamido-2-deoxy-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-D-gluco-hexopyranoseSUBMITTER
GalNAc(b1-4)GlcNAc(b1-2)[Gal(b1-4)GlcNAc(b1-4)]Man(a1-3)[GalNAc(b1-4)GlcNAc(b1-2)[GalNAc(b1-4)GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G07292LKGlyTouCan
G07292LKGlyGen