Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3R,,,6S) 6 [(,3S,4R,,) [(,,,5S,) [(2S,,,,) [(,,,,) [(,,,) 4, دی هیدروکسی ( متیل) اکسان 3 yl] اکسی ( ) یل] , , [S, [(,,,,) acetamido , dihydroxy (hydroxymethyl)oxan ]oxy , () ]oxymethyl] , dihydroxyoxan ] , (,) ( ) اگزان ] ،، تری ] متوکسی] [(1R,) 1,, پروپیل] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C67H111N5O49
اینچی
- InChI=1S/C67H111N5O49/c1-16(80)68-31-21(85)6-67(66(103)104,121-54(31)36(87)22(86)7-73)106-15-30-40(91)46(97)49(100)62(114-30)116-52-27(12-78)112-61(35(45(52)96)72-20(5)84)120-57-48(99)39(90)25(10-76)110-65(57)118-55-41(92)29(14-105-64-56(47(98)38(89)24(9-75)109-64)119-59-33(70-18(3)82)42(93)37(88)23(8-74)108-59)113-63(50(55)101)117-53-28(13-79)111-60(34(44(53)95)71-19(4)83)115-51-26(11-77)107-58(102)32(43(51)94)69-17(2)81/h21-65,73-79,85-102H,6-15H2,1-5H3,(H,68,80)(H,69,81)(H,70,82)(H,71,83)(H,72,84)(H,103,104)/t21-,22+,23+,24+,25+,26+,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+,67+/m0/s1
اینچیکی
- IDNBCPDOXIQLSO-HNEKUYOESA-N
جرم
- 1770.611
جرم تکایزوتوپی
- 1769.63476
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(O[C@@H]3CO)O)O[C@@H]([C@H]1O)CO[C@H]4O[C@@H]([C@@H](O)[C@H](O)[C@@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5NC(=O)C)CO)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]8O[C@@H]([C@H](O)[C@H](O)[C@H]8O)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]7NC(=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)-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-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)Gal(b1-4)GlcNAc(b1-2)Man(a1-3)[GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc
- WURCS=2.0/6,9,8/[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][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-4-2-5-6-4-2/a4-b1_b4-c1_c3-d1_c6-h1_d2-e1_e4-f1_f6-g2_h2-i1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:148926
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