(2S,3S,4R,5R,6R)-3-[(2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid (CHEBI:155294)

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CHEBI:155294 - (2S,3S,4R,5R,6R)-3-[(2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid

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ChEBI ID	CHEBI:155294
ChEBI Name	(2S,3S,4R,5R,6R)-3-[(2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid
Stars
Submitter	Gareth Owen
Downloads	Molfile

Formula	C31H51NO26
Net Charge	0
Average Mass	853.730
Monoisotopic Mass	853.26993
SMILES	CC(=O)N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]4[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]5CO[C@@H](O)[C@H](O)[C@H]5O)[C@@H]4O)[C@@H]3O)O[C@@H]2C(=O)O)O[C@H](CO)[C@H](O)[C@@H]1O
WURCS	WURCS=2.0/4,5,4/[a212h-1b_1-5][a2112h-1b_1-5][a2122A-1b_1-5][a2112h-1a_1-5_2*NCC/3=O]/1-2-2-3-4/a4-b1_b3-c1_c3-d1_d4-e1
InChI	InChI=1S/C31H51NO26/c1-6(36)32-11-16(41)12(37)7(2-33)51-28(11)57-24-17(42)19(44)29(58-25(24)26(47)48)55-23-15(40)9(4-35)53-31(21(23)46)56-22-14(39)8(3-34)52-30(20(22)45)54-10-5-50-27(49)18(43)13(10)38/h7-25,27-31,33-35,37-46,49H,2-5H2,1H3,(H,32,36)(H,47,48)/t7-,8-,9-,10-,11-,12+,13+,14+,15+,16-,17-,18-,19-,20-,21-,22+,23+,24+,25+,27-,28-,29-,30+,31+/m1/s1
InChIKey	KYLYHYKJKPGQGF-IYCLZFLFSA-N

ChEBI Ontology

Outgoing Relation(s)
	(2S,3S,4R,5R,6R)-3-[(2R,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid (CHEBI:155294) is a oligosaccharide (CHEBI:50699)

Synonyms	Source
2-acetamido-2-deoxy-alpha-D-galacto-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranosyluronic acid-(1->3)-beta-D-galacto-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-beta-D-xylo-pentopyranose	SUBMITTER
GalNAc(a1-4)GlcA(b1-3)Gal(b1-3)Gal(b1-4)b-Xyl	SUBMITTER

Manual Xrefs	Databases
G92237PN	GlyTouCan
G92237PN	GlyGen