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-[(2R,3R,4R,5S,6R)-2-[(2R,3R,4S,5S)-5-[(1R)-1,2-Dihydroxyethyl]-2-[(2S,3R,4S,5S,6R)-4-[(2S,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxyoxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Accession: CHEBI:153018
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Synonyms: related_synonym: 2-acetamido-2-deoxy-alpha-D-gluco-hexopyranosyl-(1->2)-alpha-D-galacto-hexofuranosyl-(1->2)-[beta-D-galacto-hexofuranosyl-(1->3)]-alpha-D-galacto-hexopyranose; Formula=C26H45NO21; GlcNAc(a1-2)Galf(a1-2)[Galf(b1-3)]a-Gal; InChI=1S/C26H45NO21/c1-6(32)27-11-14(37)12(35)9(4-30)43-24(11)47-21-17(40)19(8(34)3-29)45-26(21)48-22-20(13(36)10(5-31)42-23(22)41)46-25-16(39)15(38)18(44-25)7(33)2-28/h7-26,28-31,33-41H,2-5H2,1H3,(H,27,32)/t7-,8-,9-,10-,11-,12-,13+,14-,15-,16-,17+,18+,19+,20+,21-,22-,23+,24-,25+,26-/m1/s1; InChIKey=IKKMXLZMWWVKTD-ZVKUALDXSA-N; SMILES=O([C@H]1O[C@H]([C@H](O)[C@H]1O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O)CO)[C@@H]3[C@@H](O[C@@H]4O[C@H]([C@H](O)[C@H]4O)[C@H](O)CO)[C@@H](O)[C@H](O[C@@H]3O)CO; WURCS=2.0/4,4,3/[a2112h-1a_1-5][a2112h-1a_1-4][a2122h-1a_1-5_2*NCC/3=O][a2112h-1b_1-4]/1-2-3-4/a2-b1_a3-d1_b2-c1
xref: GlyGen:G67808LV; GlyTouCan:G67808LV
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Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
2
chemical entity
2
atom
2
nonmetal atom
2
oxygen atom
1
oxygen molecular entity
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organooxygen compound
0
carbohydrates and carbohydrate derivatives
0
glycan
0
oligosaccharide
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N-[(2R,3R,4R,5S,6R)-2-[(2R,3R,4S,5S)-5-[(1R)-1,2-Dihydroxyethyl]-2-[(2S,3R,4S,5S,6R)-4-[(2S,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxyoxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
0
Path 2
CHEBI ontology
2
subatomic particle
2
composite particle
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hadron
2
baryon
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nucleon
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atomic nucleus
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atom
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main group element atom
2
p-block element atom
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carbon group element atom
2
carbon atom
2
organic molecular entity
2
heteroorganic entity
2
organochalcogen compound
1
organooxygen compound
0
carbohydrates and carbohydrate derivatives
0
carbohydrate
0
oligosaccharide
0
N-[(2R,3R,4R,5S,6R)-2-[(2R,3R,4S,5S)-5-[(1R)-1,2-Dihydroxyethyl]-2-[(2S,3R,4S,5S,6R)-4-[(2S,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxyoxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
0