Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3R,,,6S) 6 [(,3S,4R,,) [(,,,5S,) [[(,,,) [(,,,,) [(2S,,,,) 3 [(,,,,) [[(,,,) کربوکسی 4,, [(11,,) تری هیدروکسی پروپیل] اکسان یل] اکسی متیل] ،، ] ( ) ] ، دی ( ) ایل] [(,,,,) [(,,,,) , ( ) ] ( ) ] , ] متوکسی] ، ( ) اگزان ] ،، ] ] [(1R,) 1,, ] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C84H138N6O62
اینچی
- InChI=1S/C84H138N6O62/c1-20(99)85-39-26(105)7-83(81(128)129,151-69(39)45(109)28(107)9-91)133-18-37-47(111)54(118)58(122)77(142-37)147-64-31(12-94)137-74(43(51(64)115)89-24(5)103)145-67-34(15-97)139-76(60(124)56(67)120)132-17-36-49(113)71(62(126)80(141-36)149-66-33(14-96)136-73(42(53(66)117)88-23(4)102)144-63-30(11-93)135-72(127)41(50(63)114)87-22(3)101)150-79-61(125)57(121)68(35(16-98)140-79)146-75-44(90-25(6)104)52(116)65(32(13-95)138-75)148-78-59(123)55(119)48(112)38(143-78)19-134-84(82(130)131)8-27(106)40(86-21(2)100)70(152-84)46(110)29(108)10-92/h26-80,91-98,105-127H,7-19H2,1-6H3,(H,85,99)(H,86,100)(H,87,101)(H,88,102)(H,89,103)(H,90,104)(H,128,129)(H,130,131)/t26-,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+,67+,68+,69+,70+,71-,72+,73-,74-,75-,76-,77-,78-,79+,80-,83+,84+/m0/s1
اینچیکی
- KKNPPEDMOQEWPE-DFYFVFSLSA-N
جرم
- 2224.008
جرم تکایزوتوپی
- 2222.78300
اسمایلٓ
- 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](NC(=O)C)[C@@H](O[C@@H]3CO)O)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]6O[C@@H]([C@H](O)[C@H](O)[C@H]6O)CO[C@]7(O[C@H]([C@H](NC(=O)C)[C@@H](O)C7)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]5NC(=O)C)CO)[C@H](O)[C@@H]4O)CO)[C@H]8O[C@@H]([C@@H](O[C@@H]9O[C@@H]([C@@H](O[C@@H]%10O[C@@H]([C@H](O)[C@H](O)[C@H]%10O)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)[C@H](O)[C@@H]8O)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 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->4)-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->4)-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-beta-D-gluco-hexopyranose
- NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-4)Man(a1-3)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-4)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)b-GlcNAc
- WURCS=2.0/5,11,10/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-1-2-3-1-4-5-3-1-4-5/a4-b1_b4-c1_c3-d1_c6-h1_d4-e1_e4-f1_f6-g2_h4-i1_i4-j1_j6-k2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:153752
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