Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3R,4R,,6S) 4 [(,,,5S,) 3 [(2S,,,,) [,6R4,, [(,,,,) 6 [[(,,,) کربوکسی هیدروکسی [(1R,) 1,, تری پروپیل] oxan yl]oxymethyl] ,, اکسی ]oxy [[(,,,,) acetamido [(,,,,) [[(,,,) carboxy hydroxy [(,,,,Trioxy] ] متیل] ،، یل] ( ) اکسان ] ] ، دی ] ( ) ] ، ] [(,) ,, ] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C83H135N7O60
اینچی
- InChI=1S/C83H135N7O60/c1-21(97)84-41-28(104)8-81(78(126)127,148-67(41)48(110)31(107)11-91)133-18-38-51(113)58(120)60(122)75(141-38)145-65-46(89-26(6)102)72(137-34(14-94)53(65)115)132-17-37-56(118)70(147-74-47(90-27(7)103)66(54(116)35(15-95)138-74)146-76-61(123)59(121)52(114)39(142-76)19-134-82(79(128)129)9-29(105)42(85-22(2)98)68(149-82)49(111)32(108)12-92)62(124)77(140-37)143-63-36(16-96)139-73(44(57(63)119)87-24(4)100)144-64-45(88-25(5)101)71(125)136-40(55(64)117)20-135-83(80(130)131)10-30(106)43(86-23(3)99)69(150-83)50(112)33(109)13-93/h28-77,91-96,104-125H,8-20H2,1-7H3,(H,84,97)(H,85,98)(H,86,99)(H,87,100)(H,88,101)(H,89,102)(H,90,103)(H,126,127)(H,128,129)(H,130,131)/t28-,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+,67+,68+,69+,70-,71-,72+,73-,74-,75-,76-,77-,81+,82+,83+/m0/s1
اینچیکی
- BCAHZXKYGIKWRJ-MRWZGEPOSA-N
جرم
- 2190.982
جرم تکایزوتوپی
- 2189.77277
اسمایلٓ
- O([C@H]1[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]1CO)O[C@H]2[C@@H](O)[C@H](O[C@H](O)[C@@H]2NC(=O)C)CO[C@]3(O[C@H]([C@H](NC(=O)C)[C@@H](O)C3)[C@H](O)[C@H](O)CO)C(O)=O)[C@@H]4O[C@@H]([C@H](O)[C@H](O[C@@H]5O[C@@H]([C@@H](O)[C@H](O[C@@H]6O[C@@H]([C@H](O)[C@H](O)[C@H]6O)CO[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]5NC(=O)C)CO)[C@H]4O)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@]%10(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%10)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]8NC(=O)C)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->3)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->3)-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->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)]-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose
- NeuAc(a2-6)Gal(b1-3)GlcNAc(b1-3)[NeuAc(a2-6)Gal(b1-3)GlcNAc(b1-6)]Gal(b1-4)GlcNAc(b1-3)[NeuAc(a2-6)]a-GalNAc
- WURCS=2.0/4,10,9/[a2112h-1a_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-2-3-4-2-3-4-4/a3-b1_a6-j2_b4-c1_c3-d1_c6-g1_d3-e1_e6-f2_g3-h1_h6-i2
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:150484
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