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(2R,4S,5R,6R)- 5- Acetamido- 2- [[(2R,3R,4S,5R,6S)- 6- [(2R,3S,4R,5R,6S)- 5- acetamido- 6- [(2S,3R,4S,5S,6R)- 2- [(2R,3S,4R,5R,6S)- 5- acetamido- 6- [(2R,3R,4S,5S,6R)- 2- [(2S,3R,4S,5R)- 2- acetamido- 1,4,5,6- tetrahydroxyhexan- 3- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxy- 3,4,5- trihydroxyoxan- 2- yl]methoxy]- 4- hydroxy- 6- [(1R,2R)- 1,2,3- trihydroxypropyl]oxane- 2- carboxylic acid |
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CHEBI:156840 |
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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/C53H90N4O39/c1- 14(65) 54- 18(6- 58) 41(30(72) 20(70) 7- 59) 91- 50- 39(81) 45(33(75) 22(9- 61) 86- 50) 94- 48- 29(57- 17(4) 68) 36(78) 43(25(12- 64) 89- 48) 93- 51- 40(82) 46(34(76) 23(10- 62) 87- 51) 95- 47- 28(56- 16(3) 67) 35(77) 42(24(11- 63) 88- 47) 92- 49- 38(80) 37(79) 32(74) 26(90- 49) 13- 85- 53(52(83) 84) 5- 19(69) 27(55- 15(2) 66) 44(96- 53) 31(73) 21(71) 8- 60/h18- 51,58- 64,69- 82H,5- 13H2,1- 4H3,(H,54,65) (H,55,66) (H,56,67) (H,57,68) (H,83,84) /t18- ,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- ,53+/m0/s1 |
YFOQZDKDYMPEON-AOXWZQMKSA-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] (O[C@@H] (O[C@H] ([C@@H] (NC(=O) C) CO) [C@@H] (O) [C@H] (O) CO) [C@@H] 3O) CO) O[C@@H] ([C@@H] 1O) CO) [C@@H] 4O[C@@H] ([C@@H] (O[C@@H] 5O[C@@H] ([C@H] (O) [C@H] (O) [C@H] 5O) CO[C@] 6(O[C@H] ([C@H] (NC(=O) C) [C@@H] (O) C6) [C@H] (O) [C@H] (O) CO) C(O) =O) [C@H] (O) [C@H] 4NC(=O) C) CO |
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Outgoing
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(2R,4S,5R,6R)- 5- Acetamido- 2- [[(2R,3R,4S,5R,6S)- 6- [(2R,3S,4R,5R,6S)- 5- acetamido- 6- [(2S,3R,4S,5S,6R)- 2- [(2R,3S,4R,5R,6S)- 5- acetamido- 6- [(2R,3R,4S,5S,6R)- 2- [(2S,3R,4S,5R)- 2- acetamido- 1,4,5,6- tetrahydroxyhexan- 3- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxy- 3,4,5- trihydroxyoxan- 2- yl]methoxy]- 4- hydroxy- 6- [(1R,2R)- 1,2,3- trihydroxypropyl]oxane- 2- carboxylic acid
(CHEBI:156840)
is a
carbohydrates and carbohydrate derivatives
(CHEBI:78616)
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WURCS=2.0/4,7,6/[h2112h_2*NCC/3=O][a2112h- 1b_1- 5][a2122h- 1b_1- 5_2*NCC/3=O][Aad21122h- 2a_2- 6_5*NCC/3=O]/1- 2- 3- 2- 3- 2- 4/a3- b1_b3- c1_c4- d1_d3- e1_e4- f1_f6- g2
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SUBMITTER
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