Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3S,4R,,6S) 4 [(,3R,,5S,) [(2S,,,) 6 [(1S,,,) کربوکسی هیدروکسی [(1R,) 1,,3 تری پروپیل] اکسان یل] اکسی , دی ] yl] ، ( متیل] [(,,,,) , ( ) [(,,,,) ,, ( )oxan ]oxyoxan ]oxy [,] [(,,,) [(,) ,, ] اگزان ] , ] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C70H113N5O53
اینچی
- InChI=1S/C70H113N5O53/c1-18(83)71-35-24(89)7-68(64(108)109,125-53(35)40(94)27(92)10-76)122-31(14-80)44(98)55-37(73-20(3)85)23(88)6-67(124-55,63(106)107)114-17-34-46(100)52(39(75-22(5)87)60(118-34)121-57-42(96)29(12-78)116-61(49(57)103)119-51-33(16-82)115-59(105)48(102)47(51)101)120-62-50(104)58(43(97)30(13-79)117-62)128-70(66(112)113)9-26(91)38(74-21(4)86)56(127-70)45(99)32(15-81)123-69(65(110)111)8-25(90)36(72-19(2)84)54(126-69)41(95)28(93)11-77/h23-62,76-82,88-105H,6-17H2,1-5H3,(H,71,83)(H,72,84)(H,73,85)(H,74,86)(H,75,87)(H,106,107)(H,108,109)(H,110,111)(H,112,113)/t23-,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-,67+,68+,69+,70-/m0/s1
اینچیکی
- NRHRRUFLWXMCSL-RVBWGZHISA-N
جرم
- 1872.656
جرم تکایزوتوپی
- 1871.63007
اسمایلٓ
- O([C@@H]1[C@@H](NC(=O)C)[C@@H](O[C@@H]([C@H]1O)CO[C@]2(O[C@H]([C@H](NC(=O)C)[C@@H](O)C2)[C@H](O)[C@H](O[C@]3(O[C@H]([C@H](NC(=O)C)[C@@H](O)C3)[C@H](O)[C@H](O)CO)C(O)=O)CO)C(O)=O)O[C@@H]4[C@@H](O)[C@@H](O[C@@H]([C@@H]4O)CO)O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@@H]5CO)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[C@]8(O[C@H]([C@H](NC(=O)C)[C@@H](O)C8)[C@H](O)[C@H](O)CO)C(O)=O)CO)C(O)=O)[C@H]6O)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranose
- NeuAc(a2-8)NeuAc(a2-3)Gal(b1-3)[NeuAc(a2-8)NeuAc(a2-6)]GlcNAc(b1-3)Gal(b1-4)b-Glc
- WURCS=2.0/4,8,7/[a2122h-1b_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-2-4-4-4-4/a4-b1_b3-c1_c3-d1_c6-g2_d3-e2_e8-f2_g8-h2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:153723
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