CHEBI:156712 - CID 146015796

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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 146015796
ChEBI ID CHEBI:156712
Stars This entity has been manually annotated by a third party.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
Formula C118H196N8O86
Net Charge 0
Average Mass 3102.836
Monoisotopic Mass 3101.12096
InChI InChI=1S/C118H196N8O86/c1-26(142)119-51-67(158)88(40(15-133)182-102(51)179)199-104-53(121-28(3)144)69(160)95(47(22-140)190-104)207-116-87(178)99(210-118-101(212-109-58(126-33(8)149)74(165)93(45(20-138)195-109)204-113-83(174)78(169)62(153)37(12-130)186-113)84(175)96(48(23-141)196-118)200-105-54(122-29(4)145)70(161)94(46(21-139)191-105)206-115-86(177)98(65(156)39(14-132)188-115)209-107-56(124-31(6)147)72(163)91(43(18-136)193-107)202-111-81(172)76(167)60(151)35(10-128)184-111)66(157)50(197-116)25-181-117-100(211-108-57(125-32(7)148)73(164)92(44(19-137)194-108)203-112-82(173)77(168)61(152)36(11-129)185-112)79(170)63(154)49(198-117)24-180-103-52(120-27(2)143)68(159)89(41(16-134)189-103)205-114-85(176)97(64(155)38(13-131)187-114)208-106-55(123-30(5)146)71(162)90(42(17-135)192-106)201-110-80(171)75(166)59(150)34(9-127)183-110/h34-118,127-141,150-179H,9-25H2,1-8H3,(H,119,142)(H,120,143)(H,121,144)(H,122,145)(H,123,146)(H,124,147)(H,125,148)(H,126,149)/t34-,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-,103-,104+,105+,106+,107+,108+,109+,110+,111+,112+,113+,114+,115+,116+,117+,118-/m1/s1
InChIKey OFDKQCCCODLOOW-UHKVJYBMSA-N
SMILES O([C@H]1O[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O[C@@H]4O[C@@H]([C@@H](O[C@@H]5O[C@@H]([C@H](O)[C@H](O)[C@H]5O)CO)[C@H](O)[C@H]4NC(=O)C)CO)[C@H]3O)CO)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O)[C@@H]1O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@@H]([C@H](O)[C@H](O)[C@H]7O)CO)[C@H](O)[C@H]6NC(=O)C)CO)CO)[C@H]8[C@H](O)[C@H](O[C@@H](O[C@H]9[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]9CO)O[C@H]%10[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]%10CO)O)[C@H]8O)CO[C@H]%11O[C@@H]([C@@H](O)[C@H](O)[C@@H]%11O[C@@H]%12O[C@@H]([C@@H](O[C@@H]%13O[C@@H]([C@H](O)[C@H](O)[C@@H]%13O)CO)[C@H](O)[C@H]%12NC(=O)C)CO)CO[C@@H]%14O[C@@H]([C@@H](O[C@@H]%15O[C@@H]([C@H](O)[C@H](O[C@@H]%16O[C@@H]([C@@H](O[C@@H]%17O[C@@H]([C@H](O)[C@H](O)[C@H]%17O)CO)[C@H](O)[C@H]%16NC(=O)C)CO)[C@H]%15O)CO)[C@H](O)[C@H]%14NC(=O)C)CO
ChEBI Ontology
Outgoing CID 146015796 (CHEBI:156712) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms Sources
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->4)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)]-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->6)-[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-hexopyranose SUBMITTER
Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-4)[Gal(b1-4)GlcNAc(b1-2)]Man(a1-3)[Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)[Gal(b1-4)GlcNAc(b1-2)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)b-GlcNAc SUBMITTER
WURCS=2.0/4,17,16/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5]/1-1-2-3-1-4-1-4-1-4-3-1-4-1-4-1-4/a4-b1_b4-c1_c3-d1_c6-k1_d2-e1_d4-g1_e4-f1_g4-h1_h3-i1_i4-j1_k2-l1_k6-n1_l4-m1_n4-o1_o3-p1_p4-q1 SUBMITTER
Manual Xrefs Databases
G13744OG GlyTouCan
G13744OG GlyGen
View more database links