CHEBI:155446 - N-[(2S,3R,4R,5R,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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ChEBI Name N-[(2S,3R,4R,5R,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide
ChEBI ID CHEBI:155446
Stars This entity has been manually annotated by a third party.
Submitter Gareth Owen
Supplier Information ZINC000013340162
Download Molfile XML SDF
Formula C20H35NO16
Net Charge 0
Average Mass 545.491
Monoisotopic Mass 545.19558
InChI InChI=1S/C20H35NO16/c1-5(25)21-9-17(37-20-15(31)13(29)11(27)7(3-23)35-20)16(8(4-24)33-18(9)32)36-19-14(30)12(28)10(26)6(2-22)34-19/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10+,11+,12+,13+,14-,15-,16+,17-,18+,19+,20+/m1/s1
InChIKey LYDZFUBFIMTEOS-XMXBRKLXSA-N
SMILES O([C@H]1[C@@H](O[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)CO)[C@H](O[C@H](O)[C@@H]1NC(=O)C)CO)[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO
ChEBI Ontology
Outgoing N-[(2S,3R,4R,5R,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide (CHEBI:155446) is a amino sugar (CHEBI:28963)
Synonyms Sources
beta-D-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose SUBMITTER
Gal(b1-3)[Gal(b1-4)]a-GalNAc SUBMITTER
WURCS=2.0/2,3,2/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-2/a3-b1_a4-c1 SUBMITTER
Manual Xrefs Databases
G95675JM GlyTouCan
G95675JM GlyGen
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