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CHEBI:151204 - (2S,4S,5R,6R)-5-Acetamido-6-[(1R,2R)-3-acetyloxy-1,2-dihydroxypropyl]-4-hydroxy-2-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxane-2-carboxylic acid

Default Structure
ChEBI IDCHEBI:151204
ChEBI Name(2S,4S,5R,6R)-5-Acetamido-6-[(1R,2R)-3-acetyloxy-1,2-dihydroxypropyl]-4-hydroxy-2-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxane-2-carboxylic acid
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC25H41NO20
Net Charge0
Average Mass675.590
Monoisotopic Mass675.22219
SMILESCC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)COC(C)=O)O[C@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(C(=O)O)C[C@@H]1O
WURCSWURCS=2.0/3,3,2/[a2122h-1x_1-5][a2112h-1b_1-5][Aad21122h-2b_2-6_5*NCC/3=O_9*OCC/3=O]/1-2-3/a4-b1_b6-c2
InChIInChI=1S/C25H41NO20/c1-7(28)26-13-9(30)3-25(24(39)40,46-21(13)14(32)10(31)5-41-8(2)29)42-6-12-15(33)16(34)19(37)23(44-12)45-20-11(4-27)43-22(38)18(36)17(20)35/h9-23,27,30-38H,3-6H2,1-2H3,(H,26,28)(H,39,40)/t9-,10+,11+,12+,13+,14+,15-,16-,17+,18+,19+,20+,21+,22?,23-,25-/m0/s1
InChIKeyLCCJNHMQINEXAO-KWRAQSHCSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,4S,5R,6R)-5-Acetamido-6-[(1R,2R)-3-acetyloxy-1,2-dihydroxypropyl]-4-hydroxy-2-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxane-2-carboxylic acid (CHEBI:151204) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
5-acetamido-9-O-acetyl-3,5-dideoxy-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->4)-D-gluco-hexopyranoseSUBMITTER
NeuAc9Ac(b2-6)Gal(b1-4)GlcSUBMITTER
Manual XrefsDatabases
G46656BIGlyGen
G46656BIGlyTouCan