Concept information
اصطلاح مرجح
(2S,4S,5R,6R) 2 [(,3R,,5S,) [(2R,3S,4R,,6S) 5 Acetamido 6 [(,,,,) [(,,,,,,,,, استامیدو [(,,,,) 4, دی هیدروکسی [[(,,,,) 3,, تری متیلوکسان یل] اکسی متیل] اکسان ] ، [[(,,,,) ,, ( ) oxan yl]oxymethyl] ]oxy , dihydroxy ( ) ] ( ) ] [( استیل) آمینو] [(1R,) 1,, پروپیل] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C65H108N4O49
اینچی
- InChI=1S/C65H108N4O49/c1-15-33(83)42(92)45(95)59(104-15)103-14-27-51(39(89)30(56(99)105-27)66-16(2)77)112-57-31(67-17(3)78)40(90)49(24(10-74)109-57)113-61-47(97)53(38(88)26(111-61)13-102-60-46(96)43(93)35(85)21(7-71)106-60)115-63-55(44(94)36(86)22(8-72)108-63)116-58-32(68-18(4)79)41(91)50(25(11-75)110-58)114-62-48(98)54(37(87)23(9-73)107-62)118-65(64(100)101)5-19(80)29(69-28(82)12-76)52(117-65)34(84)20(81)6-70/h15,19-27,29-63,70-76,80-81,83-99H,5-14H2,1-4H3,(H,66,77)(H,67,78)(H,68,79)(H,69,82)(H,100,101)/t15-,19+,20-,21-,22-,23-,24-,25-,26-,27-,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-,65+/m1/s1
اینچیکی
- KIKNQQITPWLOBJ-SMGVNRJNSA-N
جرم
- 1729.558
جرم تکایزوتوپی
- 1728.60822
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[C@H]4O[C@@H]([C@H](O)[C@H](O)[C@H]4O)C)O)O[C@@H]([C@H]1O)CO[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O)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@]9(O[C@H]([C@H](NC(=O)CO)[C@@H](O)C9)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]8O)CO)[C@H](O)[C@H]7NC(=O)C)CO)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 3,5-dideoxy-5-glycolamido-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-D-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-alpha-D-gluco-hexopyranose
- NeuGc(a2-3)Gal(b1-4)GlcNAc(b1-2)Man(a1-3)[Man(a1-6)]Man(b1-4)GlcNAc(a1-4)[D-Fuc(a1-6)]a-GlcNAc
- WURCS=2.0/7,9,8/[a2122h-1a_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCCO/3=O][a2112m-1a_1-5]/1-1-2-3-4-5-6-3-7/a4-b1_a6-i1_b4-c1_c3-d1_c6-h1_d2-e1_e4-f1_f3-g2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:155370
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