Concept information
اصطلاح مرجح
n-[(2s,3r,4r,5s,6r)-2-[(2r,3r,4r,5s,6s)-6-[(2r,3s,4r,5r,6s)-5-acetamido-6-[(2r,3s,4r,5s)-5-acetamido-2,4,6-trihydroxy-1-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-[(2r,3s,4s,5s,6r)-3-[(2s,3r,4r,5s,6r)-3-acetamido-5-[(2s,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[[(2s,3s,4s,5s,6r)-3-[(2s,3r,4r,5s,6r)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
نوع
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
مفهوم اعم
بار
- 0
فرمول
- C82H139N5O59
اینچی
- InChI=1S/C82H139N5O59/c1-19-41(103)53(115)59(121)76(127-19)125-17-27(102)63(43(105)26(8-88)83-21(3)97)138-73-38(85-23(5)99)50(112)65(34(15-95)134-73)140-79-62(124)68(143-82-70(57(119)47(109)32(13-93)133-82)145-75-40(87-25(7)101)52(114)66(35(16-96)136-75)141-81-71(58(120)48(110)31(12-92)132-81)146-77-60(122)54(116)42(104)20(2)128-77)67(142-72-37(84-22(4)98)49(111)44(106)28(9-89)129-72)36(137-79)18-126-80-69(56(118)46(108)30(11-91)131-80)144-74-39(86-24(6)100)51(113)64(33(14-94)135-74)139-78-61(123)55(117)45(107)29(10-90)130-78/h19-20,26-82,88-96,102-124H,8-18H2,1-7H3,(H,83,97)(H,84,98)(H,85,99)(H,86,100)(H,87,101)/t19-,20-,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-,76+,77-,78-,79-,80-,81-,82+/m0/s1
اینچیکی
- UQQGOUSKNFHXLF-FPGPVKMRSA-N
جرم
- 2138.990
جرم تکایزوتوپی
- 2137.80301
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]([C@H](O)[C@@H](NC(=O)C)CO)[C@H](O)CO[C@@H]4O[C@H]([C@@H](O)[C@@H](O)[C@@H]4O)C)[C@H]1O)CO[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@@H]([C@H](O)[C@H](O)[C@H]7O)CO)[C@H](O)[C@H]6NC(=O)C)CO)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[C@@H]%11O[C@H]([C@@H](O)[C@@H](O)[C@@H]%11O)C)CO)[C@H](O)[C@H]9NC(=O)C)CO)CO
زیرمجموعه
- 2_STAR
مترادف مرتبط
- WURCS=2.0/6,12,11/[h2122h_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][a1221m-1a_1-5]/1-2-3-4-2-5-6-2-4-2-5-6/a4-b1_a6-l1_b4-c1_c3-d1_c4-h1_c6-i1_d2-e1_e4-f1_f2-g1_i2-j1_j4-k1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:151281
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