Concept information
اصطلاح مرجح
(2S,4S,5R,6R) 5 استامیدو 2 [(2R,3R,,5S,) [(,,4R,) [[(,,,,) 3 [(,,,4) [(,,,,) acetamido [(,,,,) [(,,,) carboxy hydroxy 6 [(1R,) 1,, تری هیدروکسی , , دی پروپیل ( متیل) اکسان یل] اکسی ( ) [(,3S,,,6S) ,, متیلوکسان yl]اکسیکسان ] , ( ) ] ] ، ] ، ( ) ] [(,) ,, ] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C70H115N5O51
اینچی
- InChI=1S/C70H115N5O51/c1-17-38(92)46(100)47(101)63(111-17)119-52-31(15-82)117-62(37(75-22(6)87)56(52)121-66-50(104)59(43(97)29(13-80)115-66)126-70(68(108)109)8-24(89)34(72-19(3)84)55(124-70)40(94)26(91)10-77)122-57-41(95)27(11-78)113-64(48(57)102)118-51-30(14-81)116-61(35(45(51)99)73-20(4)85)110-16-32-44(98)53(36(60(105)112-32)74-21(5)86)120-65-49(103)58(42(96)28(12-79)114-65)125-69(67(106)107)7-23(88)33(71-18(2)83)54(123-69)39(93)25(90)9-76/h17,23-66,76-82,88-105H,7-16H2,1-6H3,(H,71,83)(H,72,84)(H,73,85)(H,74,86)(H,75,87)(H,106,107)(H,108,109)/t17-,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-,66-,69-,70-/m0/s1
اینچیکی
- RXWXFYJVWPUJPG-QFTWMENSSA-N
جرم
- 1842.674
جرم تکایزوتوپی
- 1841.65589
اسمایلٓ
- O([C@@H]1[C@@H](NC(=O)C)[C@@H](O[C@@H]([C@H]1O[C@@H]2O[C@H]([C@@H](O)[C@@H](O)[C@@H]2O)C)CO)O[C@@H]3[C@@H](O)[C@@H](O[C@@H]([C@@H]3O)CO)O[C@H]4[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]4CO)OC[C@H]5OC(O)[C@H](NC(=O)C)[C@@H](O[C@@H]6O[C@@H]([C@H](O)[C@H](O[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]6O)CO)[C@H]5O)[C@@H]8O[C@@H]([C@H](O)[C@H](O[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]8O)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->3)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->4)]-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)-[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-D-galacto-hexopyranose
- NeuAc(a2-3)Gal(b1-3)[Fuc(a1-4)]GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)[NeuAc(a2-3)Gal(b1-3)]GalNAc
- WURCS=2.0/5,9,8/[a2112h-1x_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][a1221m-1a_1-5]/1-2-3-4-2-4-2-3-5/a3-b1_a6-d1_b3-c2_d4-e1_e3-f1_f3-g1_f4-i1_g3-h2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:146065
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