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N- [(2S,3R,4R,5S,6R)- 2- [(2S,3S,4S,5S,6R)- 2- [[(2R,3R,4S,5S,6S)- 6- [(2R,3S,4R,5R,6S)- 5- Acetamido- 6- [(2R,3S,4R,5R)- 5- acetamido- 6- hydroxy- 2- (hydroxymethyl)- 4- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 3- yl]oxy- 4- hydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxy- 5- [(2S,3R,4R,5R)- 3,4- dihydroxy- 5- (hydroxymethyl)oxolan- 2- yl]oxy- 3- hydroxy- 4- [(2R,3S,4S,5S,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]methoxy]- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 3- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 3- yl]acetamide |
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CHEBI:151882 |
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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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Molfile
XML
SDF
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InChI=1S/C53H89N3O39/c1- 12- 26(66) 34(74) 38(78) 49(82- 12) 92- 42- 25(56- 15(4) 65) 46(80) 83- 21(10- 62) 41(42) 91- 48- 24(55- 14(3) 64) 33(73) 40(20(9- 61) 88- 48) 90- 53- 45(95- 50- 37(77) 30(70) 19(8- 60) 86- 50) 43(93- 51- 39(79) 35(75) 28(68) 17(6- 58) 85- 51) 31(71) 22(89- 53) 11- 81- 52- 44(36(76) 29(69) 18(7- 59) 87- 52) 94- 47- 23(54- 13(2) 63) 32(72) 27(67) 16(5- 57) 84- 47/h12,16- 53,57- 62,66- 80H,5- 11H2,1- 4H3,(H,54,63) (H,55,64) (H,56,65) /t12- ,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- ,45- ,46?,47- ,48- ,49- ,50- ,51+,52- ,53- /m0/s1 |
KJTBCPSRTNBSNS-SMFUQSKOSA-N |
O([C@H] 1[C@H] (O) [C@@H] (NC(=O) C) [C@@H] (O[C@@H] 1CO) O[C@H] 2[C@H] (O[C@@H] 3O[C@H] ([C@@H] (O) [C@@H] (O) [C@@H] 3O) C) [C@@H] (NC(=O) C) C(O[C@@H] 2CO) O) [C@@H] 4O[C@@H] ([C@@H] (O) [C@H] (O[C@H] 5O[C@@H] ([C@@H] (O) [C@H] (O) [C@@H] 5O) CO) [C@@H] 4O[C@@H] 6O[C@@H] ([C@H] (O) [C@H] 6O) CO) CO[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] 8NC(=O) C) CO) CO |
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Outgoing
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N- [(2S,3R,4R,5S,6R)- 2- [(2S,3S,4S,5S,6R)- 2- [[(2R,3R,4S,5S,6S)- 6- [(2R,3S,4R,5R,6S)- 5- Acetamido- 6- [(2R,3S,4R,5R)- 5- acetamido- 6- hydroxy- 2- (hydroxymethyl)- 4- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 3- yl]oxy- 4- hydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxy- 5- [(2S,3R,4R,5R)- 3,4- dihydroxy- 5- (hydroxymethyl)oxolan- 2- yl]oxy- 3- hydroxy- 4- [(2R,3S,4S,5S,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 2- yl]methoxy]- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 3- yl]oxy- 4,5- dihydroxy- 6- (hydroxymethyl)oxan- 3- yl]acetamide
(CHEBI:151882)
is a
amino sugar
(CHEBI:28963)
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2- acetamido- 2- deoxy- beta- D- gluco- hexopyranosyl- (1- >2)- alpha- D- manno- hexopyranosyl- (1- >6)- [beta- D- xylo- pentofuranosyl- (1- >2)][alpha- D- manno- hexopyranosyl- (1- >3)]- beta- D- manno- hexopyranosyl- (1- >4)- 2- acetamido- 2- deoxy- beta- D- gluco- hexopyranosyl- (1- >4)- [6- deoxy- alpha- L- galacto- hexopyranosyl- (1- >3)]- 2- acetamido- 2- deoxy- D- gluco- hexopyranose
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SUBMITTER
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GlcNAc(b1-2)Man(a1-6)[Xylf(b1-2)][Man(a1-3)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-3)]GlcNAc
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SUBMITTER
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WURCS=2.0/6,8,7/[a2122h- 1x_1- 5_2*NCC/3=O][a1221m- 1a_1- 5][a2122h- 1b_1- 5_2*NCC/3=O][a1122h- 1b_1- 5][a212h- 1b_1- 4][a1122h- 1a_1- 5]/1- 2- 3- 4- 5- 6- 6- 3/a3- b1_a4- c1_c4- d1_d2- e1_d3- f1_d6- g1_g2- h1
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SUBMITTER
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