Concept information
اصطلاح مرجح
(2S,4S,5R,6R) 5 استامیدو 2 [(2R,3R,,5S,) [(,,4R,,6S) [[(,,,,) 3 [,,, [(,,,,) acetamido هیدروکسی 6 ( متیل) 4 [(,,,,) ,, تری ( )oxan yl]oxyoxan ]oxy [,(R) اکسی [,,) ( ) [(,,,,) ,, ( ) ] ]oxymethyl] , dihydroxyoxan ] ( ] ( ، ، ) ] ، دی ( ) اکسان یل] [(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)104,120-55(31)36(87)22(86)7-73)121-57-40(91)26(11-77)111-65(50(57)101)117-53-34(71-19(4)83)58(102)107-29(41(53)92)14-105-59-33(70-18(3)82)44(95)52(28(13-79)113-59)116-64-49(100)56(119-61-35(72-20(5)84)54(39(90)25(10-76)108-61)118-63-48(99)46(97)38(89)24(9-75)110-63)42(93)30(114-64)15-106-60-32(69-17(2)81)43(94)51(27(12-78)112-60)115-62-47(98)45(96)37(88)23(8-74)109-62/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
- BONDZZYYDAIMDD-CHQJWDDXSA-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)OC[C@H]3O[C@H](O)[C@H](NC(=O)C)[C@@H](O[C@@H]4O[C@@H]([C@H](O)[C@H](O[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]4O)CO)[C@H]3O)O[C@@H]([C@@H]1O)CO[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@@H]([C@H](O)[C@H](O)[C@H]7O)CO)[C@H](O)[C@H]6NC(=O)C)CO)[C@@H]8O[C@@H]([C@@H](O)[C@H](O[C@@H]9O[C@@H]([C@H](O)[C@H](O)[C@H]9O)CO)[C@H]8NC(=O)C)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)]-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose
- Gal(b1-3)GlcNAc(b1-3)[Gal(b1-4)GlcNAc(b1-6)]Gal(b1-4)GlcNAc(b1-6)[NeuAc(a2-3)Gal(b1-3)]a-GalNAc
- WURCS=2.0/4,9,8/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O]/1-2-3-4-2-4-2-4-2/a3-b1_a6-d1_b3-c2_d4-e1_e3-f1_e6-h1_f3-g1_h4-i1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:147900
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