CHEBI ONTOLOGY - ANNOTATIONS
The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/ . The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/ ). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term: N-[(3R,4R,5R,6R)-2-[(3R,4S,5S,6R)-2-[(2S,3R,4R,5R,6R)-3-Acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Accession: CHEBI:156770
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Synonyms: related_synonym: 6-deoxy-L-galacto-hexopyranosyl-(1->2)-[2-acetamido-2-deoxy-D-galacto-hexopyranosyl-(1->3)]-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose; Formula=C28H48N2O20; Fuc(?1-2)[GalNAc(?1-3)]Gal(?1-3)a-GalNAc; InChI=1S/C28H48N2O20/c1-7-15(36)20(41)21(42)27(44-7)50-24-23(49-26-13(29-8(2)34)19(40)16(37)10(4-31)46-26)18(39)12(6-33)47-28(24)48-22-14(30-9(3)35)25(43)45-11(5-32)17(22)38/h7,10-28,31-33,36-43H,4-6H2,1-3H3,(H,29,34)(H,30,35)/t7-,10+,11+,12+,13+,14+,15+,16-,17-,18-,19+,20+,21-,22+,23-,24+,25-,26?,27?,28?/m0/s1; InChIKey=OEMMSBBXHGIOBY-FQQUQYLWSA-N; SMILES=O([C@@H]1[C@@H](OC2O[C@H]([C@@H](O)[C@@H](O)[C@@H]2O)C)C(O[C@@H]([C@@H]1O)CO)O[C@@H]3[C@@H](NC(=O)C)[C@H](O[C@@H]([C@@H]3O)CO)O)C4O[C@@H]([C@H](O)[C@H](O)[C@H]4NC(=O)C)CO; WURCS=2.0/4,4,3/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1x_1-5][a1221m-1x_1-5][a2112h-1x_1-5_2*NCC/3=O]/1-2-3-4/a3-b1_b2-c1_b3-d1
xref: GlyGen:G29587NV; GlyTouCan:G29587NV
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CHEBI ontology
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N-[(3R,4R,5R,6R)-2-[(3R,4S,5S,6R)-2-[(2S,3R,4R,5R,6R)-3-Acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
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organooxygen compound
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carbohydrates and carbohydrate derivatives
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N-[(3R,4R,5R,6R)-2-[(3R,4S,5S,6R)-2-[(2S,3R,4R,5R,6R)-3-Acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
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