Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 2 [[(,3R,,,6S) 6 [(,3S,4R,,) 5 Acetamido [(,,,5S,) [(2S,,,,,,,, استامیدو [(,,,,) 4, دی هیدروکسی [[(,,,,) 3,, تری متیلوکسان یل] اکسی متیل] اکسان ] . [(,,,,) acetamido , dihydroxy (hydroxymethyl)oxan yl]oxy [[(,,,,) , [(,,,,,,) ] [[(,,,,) ,, ( ) ] ] ] ] ] ، ( ) ( ) ] ،، ] متوکسی] [( استیل) آمینو] [(1R,) 1,, پروپیل] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C85H141N5O64
اینچی
- InChI=1S/C85H141N5O64/c1-19-42(106)54(118)59(123)77(136-19)133-16-34-67(51(115)38(73(129)137-34)86-20(2)99)147-75-40(88-22(4)101)52(116)66(31(13-97)142-75)149-82-64(128)71(68(150-74-39(87-21(3)100)50(114)44(108)26(8-92)138-74)35(146-82)17-134-79-63(127)70(151-80-61(125)56(120)46(110)28(10-94)140-80)49(113)32(144-79)15-132-78-60(124)55(119)45(109)27(9-93)139-78)152-83-72(58(122)47(111)29(11-95)141-83)153-76-41(89-23(5)102)53(117)65(30(12-96)143-76)148-81-62(126)57(121)48(112)33(145-81)18-135-85(84(130)131)6-24(103)37(90-36(105)14-98)69(154-85)43(107)25(104)7-91/h19,24-35,37-83,91-98,103-104,106-129H,6-18H2,1-5H3,(H,86,99)(H,87,100)(H,88,101)(H,89,102)(H,90,105)(H,130,131)/t19-,24-,25+,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,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+,78-,79-,80+,81-,82-,83+,85+/m0/s1
اینچیکی
- ODFRQMAEEAKIRM-HLUDKXCOSA-N
جرم
- 2257.034
جرم تکایزوتوپی
- 2255.79324
اسمایلٓ
- O([C@H]1[C@H](O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]3CO)O[C@H]4[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]4CO[C@@H]5O[C@H]([C@@H](O)[C@@H](O)[C@@H]5O)C)O)[C@H]1O)CO[C@H]6O[C@@H]([C@@H](O)[C@H](O[C@H]7O[C@@H]([C@@H](O)[C@H](O)[C@@H]7O)CO)[C@@H]6O)CO[C@H]8O[C@@H]([C@@H](O)[C@H](O)[C@@H]8O)CO)[C@H]9O[C@@H]([C@@H](O)[C@H](O)[C@@H]9O[C@@H]%10O[C@@H]([C@@H](O[C@@H]%11O[C@@H]([C@H](O)[C@H](O)[C@H]%11O)CO[C@]%12(O[C@H]([C@H](NC(=O)CO)[C@@H](O)C%12)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]%10NC(=O)C)CO)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 3,5-dideoxy-5-glycolamido-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-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->3)-[alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)][2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose
- NeuGc(a2-6)Gal(b1-4)GlcNAc(b1-2)Man(a1-3)[Man(a1-3)[Man(a1-6)]Man(a1-6)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]b-GlcNAc
- WURCS=2.0/6,12,11/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCCO/3=O][a1221m-1a_1-5]/1-1-2-3-1-4-5-1-3-3-3-6/a4-b1_a6-l1_b4-c1_c3-d1_c4-h1_c6-i1_d2-e1_e4-f1_f6-g2_i3-j1_i6-k1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:149333
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