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N- [(2S,3R,4R,5S,6R)- 2- [(2S,3R,4S,5S,6R)- 2- [(2R,3S,4R,5R,6R)- 5- Acetamido- 6- [[(2R,3S,4S,5R,6S)- 4- [(2S,3R,4R,5S,6R)- 3- acetamido- 6- (hydroxymethyl)- 5- [(2S,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 2- yl]oxy- 3,5- dihydroxy- 6- [(2R,3S,4R,5R)- 4,5,6- trihydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxyoxan- 2- yl]methoxy]- 2- (hydroxymethyl)- 4- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 3- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 6- (hydroxymethyl)- 5- [(2S,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 3- yl]acetamide |
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CHEBI:157242 |
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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/C66H111N3O49/c1- 14- 30(80) 37(87) 43(93) 61(101- 14) 115- 53- 28(68- 17(4) 78) 58(107- 24(11- 75) 51(53) 114- 65- 47(97) 55(34(84) 21(8- 72) 106- 65) 117- 59- 27(67- 16(3) 77) 36(86) 49(23(10- 74) 108- 59) 111- 63- 45(95) 39(89) 32(82) 19(6- 70) 104- 63) 100- 13- 26- 35(85) 56(48(98) 66(110- 26) 112- 50- 22(9- 73) 103- 57(99) 42(92) 41(50) 91) 118- 60- 29(69- 18(5) 79) 54(116- 62- 44(94) 38(88) 31(81) 15(2) 102- 62) 52(25(12- 76) 109- 60) 113- 64- 46(96) 40(90) 33(83) 20(7- 71) 105- 64/h14- 15,19- 66,70- 76,80- 99H,6- 13H2,1- 5H3,(H,67,77) (H,68,78) (H,69,79) /t14- ,15- ,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- /m0/s1 |
CTPMENKMAUMVFT-CNNPBRHTSA-N |
O([C@H] 1[C@@H] (O) [C@H] (O[C@@H] (O[C@H] 2[C@H] (O) [C@@H] (O) C(O[C@@H] 2CO) O) [C@@H] 1O) CO[C@@H] 3O[C@@H] ([C@@H] (O[C@@H] 4O[C@@H] ([C@H] (O) [C@H] (O[C@@H] 5O[C@@H] ([C@@H] (O[C@@H] 6O[C@@H] ([C@H] (O) [C@H] (O) [C@H] 6O) CO) [C@H] (O) [C@H] 5NC(=O) C) CO) [C@H] 4O) CO) [C@H] (O[C@@H] 7O[C@H] ([C@@H] (O) [C@@H] (O) [C@@H] 7O) C) [C@H] 3NC(=O) C) CO) [C@@H] 8O[C@@H] ([C@@H] (O[C@@H] 9O[C@@H] ([C@H] (O) [C@H] (O) [C@H] 9O) CO) [C@H] (O[C@@H] % 10O[C@H] ([C@@H] (O) [C@@H] (O) [C@@H] % 10O) C) [C@H] 8NC(=O) C) CO |
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Outgoing
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N- [(2S,3R,4R,5S,6R)- 2- [(2S,3R,4S,5S,6R)- 2- [(2R,3S,4R,5R,6R)- 5- Acetamido- 6- [[(2R,3S,4S,5R,6S)- 4- [(2S,3R,4R,5S,6R)- 3- acetamido- 6- (hydroxymethyl)- 5- [(2S,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxy- 4- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 2- yl]oxy- 3,5- dihydroxy- 6- [(2R,3S,4R,5R)- 4,5,6- trihydroxy- 2- (hydroxymethyl)oxan- 3- yl]oxyoxan- 2- yl]methoxy]- 2- (hydroxymethyl)- 4- [(2S,3S,4R,5S,6S)- 3,4,5- trihydroxy- 6- methyloxan- 2- yl]oxyoxan- 3- yl]oxy- 3,5- dihydroxy- 6- (hydroxymethyl)oxan- 4- yl]oxy- 4- hydroxy- 6- (hydroxymethyl)- 5- [(2S,3R,4S,5R,6R)- 3,4,5- trihydroxy- 6- (hydroxymethyl)oxan- 2- yl]oxyoxan- 3- yl]acetamide
(CHEBI:157242)
is a
carbohydrates and carbohydrate derivatives
(CHEBI:78616)
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beta- D- galacto- hexopyranosyl- (1- >4)- 2- acetamido- 2- deoxy- beta- D- gluco- hexopyranosyl- (1- >3)- beta- D- galacto- hexopyranosyl- (1- >4)- [6- deoxy- alpha- L- galacto- hexopyranosyl- (1- >3)]- 2- acetamido- 2- deoxy- beta- D- gluco- hexopyranosyl- (1- >6)- [6- deoxy- alpha- L- galacto- hexopyranosyl- (1- >3)- [beta- D- 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(b1-4)GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-6)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-3)]Gal(b1-4)Glc
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SUBMITTER
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WURCS=2.0/4,10,9/[a2122h- 1x_1- 5][a2112h- 1b_1- 5][a2122h- 1b_1- 5_2*NCC/3=O][a1221m- 1a_1- 5]/1- 2- 3- 4- 2- 3- 4- 2- 3- 2/a4- b1_b3- c1_b6- f1_c3- d1_c4- e1_f3- g1_f4- h1_h3- i1_i4- j1
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SUBMITTER
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