Concept information
اصطلاح مرجح
(2S,4S,5R,6R) 5 استامیدو 2 [(,3R,4R,,) 3 [(2R,3S,,,6S) 6 [(,,,5S,) [(,,) [[(,,,,) [(,,,,) [(,,,,) 4, دی هیدروکسی ( متیل) اکسان یل] اکسی ، ( ) ] ] [(,,,,) [(,,,) , [[(,,,, 3M, ,,,,, ,,,, 3D yl]oxymethyl]oxan ]oxy hydroxy (hydroxymethyl) ] , dihydroxyoxan ] , dihydroxy () ] ( ) ] [(1R,) 1,, تری پروپیل] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C83H137N7O58
اینچی
- InChI=1S/C83H137N7O58/c1-20-46(108)58(120)61(123)78(130-20)128-19-38-66(54(116)40(72(125)131-38)85-22(3)100)142-74-42(87-24(5)102)57(119)65(36(17-98)136-74)143-79-62(124)69(52(114)37(139-79)18-129-80-70(59(121)49(111)31(12-93)134-80)145-75-43(88-25(6)103)55(117)63(34(15-96)137-75)140-73-41(86-23(4)101)53(115)48(110)30(11-92)132-73)144-81-71(60(122)50(112)32(13-94)135-81)146-76-44(89-26(7)104)56(118)64(35(16-97)138-76)141-77-45(90-27(8)105)68(51(113)33(14-95)133-77)148-83(82(126)127)9-28(106)39(84-21(2)99)67(147-83)47(109)29(107)10-91/h20,28-81,91-98,106-125H,9-19H2,1-8H3,(H,84,99)(H,85,100)(H,86,101)(H,87,102)(H,88,103)(H,89,104)(H,90,105)(H,126,127)/t20-,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+,67+,68+,69-,70-,71-,72?,73-,74-,75-,76-,77-,78+,79-,80-,81+,83-/m0/s1
اینچیکی
- GPDOKLFBTTZCJH-HQRAJOTKSA-N
جرم
- 2161.000
جرم تکایزوتوپی
- 2159.79860
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]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[C@@H]6O[C@H]([C@@H](O)[C@@H](O)[C@@H]6O)C)O)O[C@@H]([C@H]3O)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]9O[C@@H]([C@H](O)[C@H](O)[C@H]9NC(=O)C)CO)[C@H](O)[C@H]8NC(=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)-[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->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-D-gluco-hexopyranose
- NeuAc(a2-3)GalNAc(b1-4)GlcNAc(b1-2)Man(a1-3)[GalNAc(b1-4)GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]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][a1221m-1a_1-5]/1-2-3-4-2-5-6-4-2-5-7/a4-b1_a6-k1_b4-c1_c3-d1_c6-h1_d2-e1_e4-f1_f3-g2_h2-i1_i4-j1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:148366
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