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Chemistry, part 1

زبان محتوا

پشتیبانی: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > neuraminic acids > (2s,4s,5r,6r)-2-[(2r,3r,4r,5s,6r)-2-[(2s,3r,4r,5r,6r)-3-acetamido-2-[(2r,3r,4r,5r,6s)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-[(2s,3r,4r,5r,6r)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[(2-hydroxyacetyl)amino]-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > monosaccharide derivative > ketoaldonic acid derivative > neuraminic acids > (2s,4s,5r,6r)-2-[(2r,3r,4r,5s,6r)-2-[(2s,3r,4r,5r,6r)-3-acetamido-2-[(2r,3r,4r,5r,6s)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-[(2s,3r,4r,5r,6r)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[(2-hydroxyacetyl)amino]-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

اصطلاح مرجح

(2s,4s,5r,6r)-2-[(2r,3r,4r,5s,6r)-2-[(2s,3r,4r,5r,6r)-3-acetamido-2-[(2r,3r,4r,5r,6s)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-[(2s,3r,4r,5r,6r)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[(2-hydroxyacetyl)amino]-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid  

نوع

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

مفهوم اعم

بار

  • 0

فرمول

  • C51H85N3O40

اینچی

  • InChI=1S/C51H85N3O40/c1-12(63)52-24-41(29(71)17(6-57)83-45(24)88-38-20(9-60)86-48(35(77)32(38)74)89-37-19(8-59)82-44(79)33(75)31(37)73)92-49-36(78)43(94-51(50(80)81)3-14(65)23(54-22(67)11-62)42(93-51)26(68)15(66)4-55)39(21(10-61)87-49)90-46-25(53-13(2)64)40(28(70)18(7-58)84-46)91-47-34(76)30(72)27(69)16(5-56)85-47/h14-21,23-49,55-62,65-66,68-79H,3-11H2,1-2H3,(H,52,63)(H,53,64)(H,54,67)(H,80,81)/t14-,15+,16+,17+,18+,19+,20+,21+,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-,51-/m0/s1

اینچی‌کی

  • LWUKZZVBFCIDIY-QCRCEIPVSA-N

جرم

  • 1380.222

جرم تک‌ایزوتوپی

  • 1379.47093

اسمایلٓ

  • O([C@H]1[C@@H](O[C@@H]2O[C@@H]([C@H](O)[C@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO)[C@H]2NC(=O)C)CO)[C@H](O[C@@H](O[C@@H]4[C@@H](NC(=O)C)[C@@H](O[C@@H]([C@@H]4O)CO)O[C@@H]5[C@H](O)[C@@H](O)[C@@H](O[C@@H]5CO)O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@@H]6CO)O)[C@@H]1O)CO)[C@]7(O[C@H]([C@H](NC(=O)CO)[C@@H](O)C7)[C@H](O)[C@H](O)CO)C(O)=O

زیرمجموعه

  • 2_STAR

مترادف مرتبط

  • beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-[3,5-dideoxy-5-glycolamido-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)]-beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-beta-D-galacto-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranose
  • Gal(b1-3)GalNAc(b1-4)[NeuGc(a2-3)]Gal(b1-3)GalNAc(b1-4)Gal(b1-4)b-Glc
  • WURCS=2.0/4,7,6/[a2122h-1b_1-5][a2112h-1b_1-5][a2112h-1b_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCCO/3=O]/1-2-3-2-4-3-2/a4-b1_b4-c1_c3-d1_d3-e2_d4-f1_f3-g1

در زبان های دیگر

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:151752

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