Concept information
اصطلاح مرجح
(2S,4S,5R,6R) 5 استامیدو 2 [(,3R,4R,,) 3 [(2R,3S,,,6S) 6 [(,,,5S,) [(,,) [[(,,,,) [(,,,,) 4 [(,,,,) [(,,,) کربوکسی ,, [(11,) تری هیدروکسی پروپیل] اکسان یل] اکسی ، دی ( متیل) ] ( ) اگزان ] ، ( ) ] ] ، ، ، ، ، ، ، ، ، ، ، ، [(,,,) , ( ) ] ( ) ] , ] , , ( ) ( ) ] ( ) ] [(1R,) 1,, ] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C86H141N7O62
اینچی
- InChI=1S/C86H141N7O62/c1-21(104)87-41-28(111)8-85(83(131)132,152-67(41)48(115)30(113)10-94)154-69-47(93-27(7)110)78(138-35(15-99)53(69)120)146-64-38(18-102)143-76(45(57(64)124)91-25(5)108)151-73-60(127)51(118)33(13-97)141-82(73)149-70-55(122)40(144-79(61(70)128)147-65-39(19-103)142-75(44(58(65)125)90-24(4)107)145-63-37(17-101)136-74(130)43(56(63)123)89-23(3)106)20-135-81-72(59(126)50(117)32(12-96)140-81)150-77-46(92-26(6)109)66(52(119)34(14-98)137-77)148-80-62(129)71(54(121)36(16-100)139-80)155-86(84(133)134)9-29(112)42(88-22(2)105)68(153-86)49(116)31(114)11-95/h28-82,94-103,111-130H,8-20H2,1-7H3,(H,87,104)(H,88,105)(H,89,106)(H,90,107)(H,91,108)(H,92,109)(H,93,110)(H,131,132)(H,133,134)/t28-,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-,71-,72-,73-,74?,75-,76-,77-,78-,79-,80-,81-,82+,85-,86-/m0/s1
اینچیکی
- YNBGKAHBLNHRFP-DALHNPSCSA-N
جرم
- 2265.061
جرم تکایزوتوپی
- 2263.80955
اسمایلٓ
- O([C@H]1[C@H](O)[C@@H](NC(=O)C)[C@H](O[C@@H]2[C@@H](O[C@H]3[C@H](O)[C@H](O[C@@H](O[C@H]4[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]4CO)O[C@H]5[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]5CO)O)[C@H]3O)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]8O[C@@H]([C@H](O)[C@H](O[C@]9(O[C@H]([C@H](NC(=O)C)[C@@H](O)C9)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]8O)CO)[C@H]7NC(=O)C)CO)CO)O[C@@H]([C@@H](O)[C@@H]2O)CO)O[C@@H]1CO)[C@@H]%10O[C@@H]([C@H](O)[C@H](O[C@]%11(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%11)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%10NC(=O)C)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-gluco-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-D-gluco-hexopyranose
- NeuAc(a2-3)GalNAc(b1-4)GlcNAc(b1-2)Man(a1-3)[NeuAc(a2-3)Gal(b1-3)GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc
- WURCS=2.0/7,11,10/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O][a2112h-1b_1-5]/1-2-3-4-2-5-6-4-2-7-6/a4-b1_b4-c1_c3-d1_c6-h1_d2-e1_e4-f1_f3-g2_h2-i1_i3-j1_j3-k2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:150323
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