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N- [(2R,3R,4R,5S,6R)- 5- [(2S,3R,4R,5S,6R)- 3- Acetamido- 5- [(2S,3S,4S,5R,6R)- 4- [(2R,3S,4S,5S,6R)- 3- [(2R,3S,4S,5S,6R)- 3- [(2R,3S,4S,5S,6R)- 3- [(2R,3S,4S,5S,6R)- 3- [(2S,3S,4S,5S,6R)- 4,5- dihydroxy- 6- (hydroxymethyl)- 3- [(2R,3S,4S,5S,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 6- [[(2S,3S,4S,5S,6R)- 4,5- dihydroxy- 6- (hydroxymethyl)- 3- [(2R,3S,4S,5S,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]oxymethyl]- 3,5- dihydroxyoxan- 2- yl]oxy- 4- hydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 2,4- dihydroxy- 6- (hydroxymethyl)oxan- 3- yl]acetamide |
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CHEBI:157027 |
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This entity has been manually annotated by a third party.
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Gareth Owen
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Molfile
XML
SDF
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InChI=1S/C70H118N2O56/c1- 14(83) 71- 27- 38(94) 51(24(11- 81) 109- 60(27) 107) 120- 61- 28(72- 15(2) 84) 39(95) 52(25(12- 82) 118- 61) 121- 64- 50(106) 53(37(93) 26(119- 64) 13- 108- 65- 54(42(98) 31(87) 18(5- 75) 112- 65) 123- 62- 48(104) 40(96) 29(85) 16(3- 73) 110- 62) 122- 66- 56(44(100) 33(89) 19(6- 76) 113- 66) 125- 68- 58(46(102) 35(91) 21(8- 78) 115- 68) 127- 70- 59(47(103) 36(92) 23(10- 80) 117- 70) 128- 69- 57(45(101) 34(90) 22(9- 79) 116- 69) 126- 67- 55(43(99) 32(88) 20(7- 77) 114- 67) 124- 63- 49(105) 41(97) 30(86) 17(4- 74) 111- 63/h16- 70,73- 82,85- 107H,3- 13H2,1- 2H3,(H,71,83) (H,72,84) /t16- ,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+,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- /m1/s1 |
XKHYWESCOMXVEN-NRVDKXMHSA-N |
O([C@@H] 1[C@H] (O) [C@H] (O[C@H] 2[C@H] (O) [C@@H] (NC(=O) C) [C@@H] (O[C@@H] 2CO) O[C@H] 3[C@H] (O) [C@@H] (NC(=O) C) [C@@H] (O[C@@H] 3CO) O) O[C@@H] ([C@H] 1O) CO[C@H] 4O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 4O[C@H] 5O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 5O) CO) CO) [C@H] 6O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 6O[C@H] 7O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 7O[C@H] 8O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 8O[C@H] 9O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 9O[C@H] % 10O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] % 10O[C@H] % 11O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] % 11O) CO) CO) CO) CO) CO) CO |
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Outgoing
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N- [(2R,3R,4R,5S,6R)- 5- [(2S,3R,4R,5S,6R)- 3- Acetamido- 5- [(2S,3S,4S,5R,6R)- 4- [(2R,3S,4S,5S,6R)- 3- [(2R,3S,4S,5S,6R)- 3- [(2R,3S,4S,5S,6R)- 3- [(2R,3S,4S,5S,6R)- 3- [(2S,3S,4S,5S,6R)- 4,5- dihydroxy- 6- (hydroxymethyl)- 3- [(2R,3S,4S,5S,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 6- [[(2S,3S,4S,5S,6R)- 4,5- dihydroxy- 6- (hydroxymethyl)- 3- [(2R,3S,4S,5S,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]oxymethyl]- 3,5- dihydroxyoxan- 2- yl]oxy- 4- hydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 2,4- dihydroxy- 6- (hydroxymethyl)oxan- 3- yl]acetamide
(CHEBI:157027)
is a
carbohydrates and carbohydrate derivatives
(CHEBI:78616)
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alpha- D- manno- hexopyranosyl- (1- >2)- alpha- D- manno- hexopyranosyl- (1- >2)- alpha- D- manno- hexopyranosyl- (1- >2)- alpha- D- manno- hexopyranosyl- (1- >2)- alpha- D- manno- hexopyranosyl- (1- >2)- alpha- D- manno- hexopyranosyl- (1- >3)- [alpha- D- manno- 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
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SUBMITTER
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Man(a1- 2)Man(a1- 2)Man(a1- 2)Man(a1- 2)Man(a1- 2)Man(a1- 3)[Man(a1- 2)Man(a1- 6)]Man(b1- 4)GlcNAc(b1- 4)b- GlcNAc
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SUBMITTER
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WURCS=2.0/3,11,10/[a2122h- 1b_1- 5_2*NCC/3=O][a1122h- 1b_1- 5][a1122h- 1a_1- 5]/1- 1- 2- 3- 3- 3- 3- 3- 3- 3- 3/a4- b1_b4- c1_c3- d1_c6- j1_d2- e1_e2- f1_f2- g1_g2- h1_h2- i1_j2- k1
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SUBMITTER
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