Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3R,4R,,6S) 6 [(,3S,,,) [(,,,5S,) [,(,) [,, [(2S,,,,) 3 [(,,,,) [(,,,,) [[(,,,) کربوکسی [(11,,) 4 هیدروکسی تری پروپیل] اکسان یل] اکسی متیل] ،، ] ( ) ] ، دی ( ) ] ] [(,,,, ,,4Smi,,,,,,, ,,,,,,,, ,,,, , ,,, [(,,,) , ( ) ] ( ) ] , ] , , ( ) ( ) ] ، ] متوکسی] [(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(102)87-41-28(109)8-85(83(131)132,154-69(41)48(113)30(111)10-94)136-19-39-52(117)55(120)44(90-24(4)105)75(144-39)148-66-35(15-99)142-78(46(57(66)122)92-26(6)107)153-73-62(127)51(116)33(13-97)140-82(73)151-71-54(119)38(145-80(64(71)129)150-68-37(17-101)141-76(45(58(68)123)91-25(5)106)147-65-34(14-98)138-74(130)43(56(65)121)89-23(3)104)18-135-81-72(61(126)50(115)32(12-96)139-81)152-77-47(93-27(7)108)59(124)67(36(16-100)143-77)149-79-63(128)60(125)53(118)40(146-79)20-137-86(84(133)134)9-29(110)42(88-22(2)103)70(155-86)49(114)31(112)11-95/h28-82,94-101,109-130H,8-20H2,1-7H3,(H,87,102)(H,88,103)(H,89,104)(H,90,105)(H,91,106)(H,92,107)(H,93,108)(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
- WJSQXUXCDNBOCR-WBUBCDGPSA-N
جرم
- 2265.061
جرم تکایزوتوپی
- 2263.80955
اسمایلٓ
- O([C@@H]1[C@H](O)[C@@H](O[C@@H]([C@H]1O)CO[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@@H]2O[C@@H]3O[C@@H]([C@@H](O[C@@H]4O[C@@H]([C@H](O)[C@H](O)[C@H]4O)CO[C@]5(O[C@H]([C@H](NC(=O)C)[C@@H](O)C5)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]3NC(=O)C)CO)CO)O[C@H]6[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]6CO)O[C@H]7[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]7CO)O)[C@H]8O[C@@H]([C@@H](O)[C@H](O)[C@@H]8O[C@@H]9O[C@@H]([C@@H](O[C@@H]%10O[C@@H]([C@H](O)[C@H](O)[C@H]%10NC(=O)C)CO[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](O)[C@H]9NC(=O)C)CO)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-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->6)-beta-D-galacto-hexopyranosyl-(1->4)-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(a2-6)GalNAc(b1-4)GlcNAc(b1-2)Man(a1-3)[NeuAc(a2-6)Gal(b1-4)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_f6-g2_h2-i1_i4-j1_j6-k2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:154811
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