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(2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3R,4S,5R,6R)-6-[(2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-2-carboxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

PropertiesImageOccurences in reactions
MNX_IDMNXM1112547Image of MNXM1112547
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC48H79N3O37
charge0
mass1289.43924
referencechebi:146453
InChIKeyXVKKDSXATIEDAB-SDZNIUIJSA-N
InChIInChI=1S/C48H79N3O37/c1-12(56)49-23-15(59)4-47(45(74)75,87-39(23)26(62)16(60)6-52)78-11-22-29(65)31(67)35(71)43(84-22)81-18-5-48(46(76)77,88-40(24(18)50-13(2)57)27(63)17(61)7-53)79-10-21-28(64)30(66)25(51-14(3)58)42(83-21)85-38-20(9-55)82-44(36(72)33(38)69)86-37-19(8-54)80-41(73)34(70)32(37)68/h15-44,52-55,59-73H,4-11H2,1-3H3,(H,49,56)(H,50,57)(H,51,58)(H,74,75)(H,76,77)/t15-,16+,17+,18-,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+,29-,30+,31-,32+,33+,34+,35+,36+,37+,38-,39+,40+,41?,42-,43+,44-,47+,48+/m0/s1
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](CO)OC(O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)O[C@H](CO[C@]2(C(=O)O)C[C@H](O[C@@H]3O[C@H](CO[C@]4(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)[C@H](O)[C@H](O)[C@H]3O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O2)[C@@H](O)[C@@H]1O
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:146453
chebi:146453
(2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3R,4S,5R,6R)-6-[(2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-2-carboxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->4)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-beta-D-galacto-hexopyranosyl-(1->4)-D-gluco-hexopyranose
NeuAc(a2-6)Gal(b1-4)NeuAc(a2-6)GlcNAc(b1-4)Gal(b1-4)Glc
WURCS=2.0/4,6,5/[a2122h-1x_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-4-2-4/a4-b1_b4-c1_c6-d2_d4-e1_e6-f2