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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > (2s,4s,5r,6r)-5-acetamido-2-[(2r,3s,4r,5r,6s)-3-[(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-5-hydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-n-methyl-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > (2s,4s,5r,6r)-5-acetamido-2-[(2r,3s,4r,5r,6s)-3-[(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-5-hydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-n-methyl-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > (2s,4s,5r,6r)-5-acetamido-2-[(2r,3s,4r,5r,6s)-3-[(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-5-hydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-n-methyl-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxamide

Preferred term

(2s,4s,5r,6r)-5-acetamido-2-[(2r,3s,4r,5r,6s)-3-[(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-5-hydroxy-2-(hydroxymethyl)-6-[(2r,3s,4r,5r,6r)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-n-methyl-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C38H65N3O28

inchi

  • InChI=1S/C38H65N3O28/c1-10(47)40-18-12(49)4-38(37(60)39-3,68-31(18)20(51)13(50)5-42)69-32-27(58)36(65-28-16(8-45)61-33(59)25(56)24(28)55)64-17(9-46)29(32)66-34-19(41-11(2)48)30(22(53)15(7-44)62-34)67-35-26(57)23(54)21(52)14(6-43)63-35/h12-36,42-46,49-59H,4-9H2,1-3H3,(H,39,60)(H,40,47)(H,41,48)/t12-,13+,14+,15+,16+,17+,18+,19+,20+,21-,22-,23-,24+,25+,26+,27+,28+,29-,30+,31+,32+,33+,34-,35-,36-,38-/m0/s1

inchikey

  • MQDDOLPAGZDDKZ-USOQFWORSA-N

mass

  • 1011.931

monoisotopicmass

  • 1011.37546

smiles

  • 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](O)[C@@H](O)[C@@H](O[C@@H]4CO)O)[C@@H]1O)CO)[C@]5(O[C@H]([C@H](NC(=O)C)[C@@H](O)C5)[C@H](O)[C@H](O)CO)C(=O)NC

subset

  • 2_STAR

synonym RELATED

  • WURCS=2.0/4,5,4/[a2122h-1b_1-5][a2112h-1b_1-5][Aad21122h-2a_2-6_1*NC_5*NCC/3=O][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-4-2/a4-b1_b3-c2_b4-d1_d3-e1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:152905

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