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(2S,4S,5R,6R)- 5- Acetamido- 2- [(2R,3R,4S,5S,6R)- 2- [(2S,3R,4R,5S,6R)- 3- acetamido- 2- [(2R,3S,4S,5R,6S)- 2- [[(2R,3R,4R,5S,6R)- 3- acetamido- 5- [(2S,3R,4S,5S,6R)- 4- [(2S,3R,4R,5S,6R)- 3- acetamido- 5- hydroxy- 6- (hydroxymethyl)- 4- [(2R,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4- hydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxymethyl]- 3,5- dihydroxy- 6- [(2R,3S,4R,5R)- 4,5,6- trihydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxyoxan- 4- yl]oxy- 6- (hydroxymethyl)- 5- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 4- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 6- [(1R,2R)- 1,2,3- trihydroxypropyl]oxane- 2- carboxylic acid |
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CHEBI:155447 |
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![](images/goldenstar.gif) ![](images/goldenstar.gif)
This entity has been manually annotated by a third party.
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Gareth Owen
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No supplier information found for this compound. |
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Molfile
XML
SDF
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InChI=1S/C71H118N4O53/c1- 16- 35(90) 43(98) 47(102) 65(111- 16) 122- 54- 29(14- 83) 118- 64(34(75- 20(5) 87) 57(54) 124- 69- 51(106) 60(40(95) 26(11- 80) 116- 69) 128- 71(70(108) 109) 6- 21(88) 31(72- 17(2) 84) 56(127- 71) 36(91) 22(89) 7- 76) 126- 59- 41(96) 30(119- 68(50(59) 105) 121- 53- 27(12- 81) 112- 61(107) 46(101) 45(53) 100) 15- 110- 62- 32(73- 18(3) 85) 42(97) 52(28(13- 82) 117- 62) 120- 67- 49(104) 58(39(94) 25(10- 79) 115- 67) 125- 63- 33(74- 19(4) 86) 55(38(93) 24(9- 78) 113- 63) 123- 66- 48(103) 44(99) 37(92) 23(8- 77) 114- 66/h16,21- 69,76- 83,88- 107H,6- 15H2,1- 5H3,(H,72,84) (H,73,85) (H,74,86) (H,75,87) (H,108,109) /t16- ,21- ,22+,23+,24+,25+,26+,27+,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- ,71- /m0/s1 |
QDNUALRMIZBLQP-XIBPMSGXSA-N |
O([C@@H] 1[C@@H] (NC(=O) C) [C@@H] (O[C@@H] ([C@H] 1O[C@@H] 2O[C@H] ([C@@H] (O) [C@@H] (O) [C@@H] 2O) C) CO) O[C@H] 3[C@@H] (O) [C@H] (O[C@@H] (O[C@H] 4[C@H] (O) [C@@H] (O) C(O[C@@H] 4CO) O) [C@@H] 3O) CO[C@@H] 5O[C@@H] ([C@@H] (O[C@@H] 6O[C@@H] ([C@H] (O) [C@H] (O[C@@H] 7O[C@@H] ([C@@H] (O) [C@H] (O[C@@H] 8O[C@@H] ([C@H] (O) [C@H] (O) [C@H] 8O) CO) [C@H] 7NC(=O) C) CO) [C@H] 6O) CO) [C@H] (O) [C@H] 5NC(=O) C) CO) [C@@H] 9O[C@@H] ([C@H] (O) [C@H] (O[C@] % 10(O[C@H] ([C@H] (NC(=O) C) [C@@H] (O) C% 10) [C@H] (O) [C@H] (O) CO) C(O) =O) [C@H] 9O) CO |
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Outgoing
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(2S,4S,5R,6R)- 5- Acetamido- 2- [(2R,3R,4S,5S,6R)- 2- [(2S,3R,4R,5S,6R)- 3- acetamido- 2- [(2R,3S,4S,5R,6S)- 2- [[(2R,3R,4R,5S,6R)- 3- acetamido- 5- [(2S,3R,4S,5S,6R)- 4- [(2S,3R,4R,5S,6R)- 3- acetamido- 5- hydroxy- 6- (hydroxymethyl)- 4- [(2R,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4- hydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxymethyl]- 3,5- dihydroxy- 6- [(2R,3S,4R,5R)- 4,5,6- trihydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxyoxan- 4- yl]oxy- 6- (hydroxymethyl)- 5- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 4- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 6- [(1R,2R)- 1,2,3- trihydroxypropyl]oxane- 2- carboxylic acid
(CHEBI:155447)
is a
neuraminic acids
(CHEBI:25508)
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beta- D- galacto- hexopyranosyl- (1- >3)- 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)- [5- acetamido- 3,5- dideoxy- D- glycero- alpha- D- galacto- non- 2- ulopyranosylonic acid- (2- >3)- beta- D- galacto- hexopyranosyl- (1- >3)- [6- deoxy- alpha- L- galacto- hexopyranosyl- (1- >4)]- 2- acetamido- 2- deoxy- beta- D- gluco- hexopyranosyl- (1- >3)]- beta- D- galacto- hexopyranosyl- (1- >4)- D- gluco- hexopyranose
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SUBMITTER
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Gal(b1-3)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)[NeuAc(a2-3)Gal(b1-3)[Fuc(a1-4)]GlcNAc(b1-3)]Gal(b1-4)Glc
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SUBMITTER
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WURCS=2.0/5,10,9/[a2122h- 1x_1- 5][a2112h- 1b_1- 5][a2122h- 1b_1- 5_2*NCC/3=O][Aad21122h- 2a_2- 6_5*NCC/3=O][a1221m- 1a_1- 5]/1- 2- 3- 2- 4- 5- 3- 2- 3- 2/a4- b1_b3- c1_b6- g1_c3- d1_c4- f1_d3- e2_g4- h1_h3- i1_i3- j1
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SUBMITTER
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