Concept information
اصطلاح مرجح
(2R,4S,5R,6R) 5 استامیدو 2 [[(,3R,,,6S) 6 [(,3S,4R,,) [(,,,5S,) [(2S,,,,) [(,,,,) acetamido [(,,,) 4, dihydroxy [[(,,,,) 3,, تری هیدروکسی متیلوکسان هیدروکسان ] اکسی . ( متیل) اکسان یل] [[(,,,,) [(,,,,) , دی ( ) [(,,,,) ,, ,, yl] ، ( ) ] ] ، ] ، ( ) ] ( ) ، یولوکسی] [(1R,) 1,, پروپیل] کربوکسیلیک اسید
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C77H128N4O58
اینچی
- InChI=1S/C77H128N4O58/c1-17-37(95)48(106)53(111)69(122-17)120-15-32-60(45(103)34(66(116)123-32)79-19(3)90)132-67-35(80-20(4)91)46(104)59(29(13-88)128-67)134-73-57(115)63(44(102)30(130-73)14-119-70-56(114)62(43(101)27(11-86)124-70)135-75-65(52(110)41(99)26(10-85)127-75)138-71-54(112)49(107)39(97)24(8-83)125-71)136-74-64(51(109)40(98)25(9-84)126-74)137-68-36(81-21(5)92)47(105)58(28(12-87)129-68)133-72-55(113)50(108)42(100)31(131-72)16-121-77(76(117)118)6-22(93)33(78-18(2)89)61(139-77)38(96)23(94)7-82/h17,22-75,82-88,93-116H,6-16H2,1-5H3,(H,78,89)(H,79,90)(H,80,91)(H,81,92)(H,117,118)/t17-,22-,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?,67-,68-,69+,70-,71+,72-,73-,74+,75+,77+/m0/s1
اینچیکی
- ABCCGKQCPNKZQT-KLDWURPASA-N
جرم
- 2037.841
جرم تکایزوتوپی
- 2036.71895
اسمایلٓ
- O([C@@H]1[C@H](O)[C@H](O[C@H]2[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]2CO)O[C@H]3[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]3CO[C@@H]4O[C@H]([C@@H](O)[C@@H](O)[C@@H]4O)C)O)O[C@@H]([C@H]1O)CO[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[C@H]7O[C@@H]([C@@H](O)[C@H](O)[C@@H]7O)CO)CO)[C@@H]5O)CO)[C@H]8O[C@@H]([C@@H](O)[C@H](O)[C@@H]8O[C@@H]9O[C@@H]([C@@H](O[C@@H]%10O[C@@H]([C@H](O)[C@H](O)[C@H]%10O)CO[C@]%11(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%11)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]9NC(=O)C)CO)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->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->6)]-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-D-gluco-hexopyranose
- NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)Man(a1-3)[Man(a1-2)Man(a1-3)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAc
- WURCS=2.0/7,11,10/[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][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-2-3-4-2-5-6-4-4-4-7/a4-b1_a6-k1_b4-c1_c3-d1_c6-h1_d2-e1_e4-f1_f6-g2_h3-i1_i2-j1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:148320
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