Concept information
اصطلاح مرجح
N [(3R,4R,5S,6R) 5 [(2S,3R,4R,5S,6R) 3 Acetamido 5 [(2S,3S,4S,5R,6R) 6 [[(2S,3S,4S,5S,6R) 3 [(2S,3R,4R,5S,6R) [(2S,3R,4R,5R,6R) 3 acetamido 4,5 dihydroxy 6 (hydroxymethyl)oxan 2 yl]oxy 4 hydroxy 6 (hydroxymethyl)oxan 2 yl]oxy 4,5 dihydroxy 6 (hydroxymethyl)oxan 2 yl4Symethyl[3,4Symethyl] 3,5 bis[[(2S,3R,4R,5S,6R) 3 acetamido 5 [(2S,3R,4R,5R,6R) 3 acetamido 4,5 dihydroxy 6 (hydroxymethyl)oxan 2 yl]oxy 4 hydroxy 6 (هیدروکسی متیل) هیدروکسی اکسی 2 2 yl]اکسی 3،5 دی هیدروکسی 2 یل] اکسی 4 هیدروکسی 6 (هیدروکسی متیل) اگزان 2 یل] اکسی 2،4 دی هیدروکسی 6 (هیدروکسی متیل) اکسان 3 یل] استامید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C82H136N8O56
اینچی
- InChI=1S/C82H136N8O56/c1-20(101)83-39-55(117)63(32(13-95)127-72(39)125)138-76-44(88-25(6)106)59(121)67(36(17-99)133-76)143-80-62(124)69(51(113)38(137-80)19-126-81-70(60(122)50(112)31(12-94)131-81)145-78-45(89-26(7)107)57(119)65(34(15-97)134-78)140-74-41(85-22(3)103)53(115)48(110)29(10-92)129-74)144-82-71(146-79-46(90-27(8)108)58(120)66(35(16-98)135-79)141-75-42(86-23(4)104)54(116)49(111)30(11-93)130-75)61(123)68(37(18-100)136-82)142-77-43(87-24(5)105)56(118)64(33(14-96)132-77)139-73-40(84-21(2)102)52(114)47(109)28(9-91)128-73/h28-82,91-100,109-125H,9-19H2,1-8H3,(H,83,101)(H,84,102)(H,85,103)(H,86,104)(H,87,105)(H,88,106)(H,89,107)(H,90,108)/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+,78+,79+,80+,81+,82-/m1/s1
اینچیکی
- NEPKTJYVANKHSG-DNUMSAMYSA-N
جرم
- 2129.990
جرم تکایزوتوپی
- 2128.80402
اسمایلٓ
- O([C@H]1O[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3NC(=O)C)CO)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O)[C@@H]1O[C@@H]4O[C@@H]([C@@H](O[C@@H]5O[C@@H]([C@H](O)[C@H](O)[C@H]5NC(=O)C)CO)[C@H](O)[C@H]4NC(=O)C)CO)CO)[C@H]6[C@H](O)[C@H](O[C@@H](O[C@H]7[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]7CO)O[C@H]8[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]8CO)O)[C@H]6O)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]%11NC(=O)C)CO)[C@H](O)[C@H]%10NC(=O)C)CO)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- 2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose
- GalNAc(b1-4)GlcNAc(b1-2)[GalNAc(b1-4)GlcNAc(b1-4)]Man(a1-3)[GalNAc(b1-4)GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc
- WURCS=2.0/5,11,10/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-4-2-5-2-5-4-2-5/a4-b1_b4-c1_c3-d1_c6-i1_d2-e1_d4-g1_e4-f1_g4-h1_i2-j1_j4-k1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:148634
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