Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3R,4R,,6S) 4 [(,,,5S,) 3 [(2S,,,,) [,4R5,, [(,,,,) 6 [[(,,,) کربوکسی هیدروکسی [(1R,) 1,, تری پروپیل]oxan yl]oxymethyl] [(,3S,,,) ( متیل) اکسان یل] اکسی ، دی ] ( ) ] [[(,,,) [(,proxy2,) ] ] ، ] ( ) ] ، ] متوکسی] [(,) ،، ] کربوکسیلیک اسید2
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C77H125N7O55
اینچی
- InChI=1S/C77H125N7O55/c1-20(91)78-39-27(98)8-75(72(117)118,137-61(39)46(104)30(101)11-85)123-17-36-50(108)60(45(66(116)126-36)84-26(7)97)134-68-43(82-24(5)95)54(112)58(34(15-89)128-68)132-71-57(115)65(52(110)38(131-71)19-125-77(74(121)122)10-29(100)41(80-22(3)93)63(139-77)48(106)32(103)13-87)136-69-44(83-25(6)96)55(113)59(35(16-90)129-69)133-70-56(114)64(135-67-42(81-23(4)94)53(111)49(107)33(14-88)127-67)51(109)37(130-70)18-124-76(73(119)120)9-28(99)40(79-21(2)92)62(138-76)47(105)31(102)12-86/h27-71,85-90,98-116H,8-19H2,1-7H3,(H,78,91)(H,79,92)(H,80,93)(H,81,94)(H,82,95)(H,83,96)(H,84,97)(H,117,118)(H,119,120)(H,121,122)/t27-,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-,75+,76+,77+/m0/s1
اینچیکی
- VCKNUQHXYVADSB-GYEYQROXSA-N
جرم
- 2028.841
جرم تکایزوتوپی
- 2027.71995
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](O[C@H](O)[C@@H]3NC(=O)C)CO[C@]4(O[C@H]([C@H](NC(=O)C)[C@@H](O)C4)[C@H](O)[C@H](O)CO)C(O)=O)O[C@@H]([C@@H]1O)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]6O[C@@H]([C@@H](O[C@@H]7O[C@@H]([C@H](O)[C@H](O[C@@H]8O[C@@H]([C@@H](O)[C@H](O)[C@H]8NC(=O)C)CO)[C@H]7O)CO[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](O)[C@H]6NC(=O)C)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 2-acetamido-2-deoxy-beta-D-gluco-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->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->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)]-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose
- GlcNAc(b1-3)[NeuAc(a2-6)]Gal(b1-4)GlcNAc(b1-3)[NeuAc(a2-6)]Gal(b1-4)GlcNAc(b1-3)[NeuAc(a2-6)]a-GalNAc
- WURCS=2.0/4,9,8/[a2112h-1a_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-2-3-2-4-4-4/a3-b1_a6-i2_b4-c1_c3-d1_c6-h2_d4-e1_e3-f1_e6-g2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:152801
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