N-[(2R,3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(2R,3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:150368)

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CHEBI:150368 - N-[(2R,3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(2R,3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide

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ChEBI ID	CHEBI:150368
ChEBI Name	N-[(2R,3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(2R,3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide
Stars
Submitter	Gareth Owen
Downloads	Molfile

Formula	C26H47NO20
Net Charge	0
Average Mass	693.649
Monoisotopic Mass	693.26914
SMILES	CC(=O)N[C@H]1[C@H](O[C@H](CO)[C@@H](O)[C@H](O)[C@H](O)CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O
WURCS	WURCS=2.0/4,4,3/[h1122h][a2122h-1b_1-5_2*NCC/3=O][a1221m-1a_1-5][a2112h-1b_1-5]/1-2-3-4/a5-b1_b3-c1_b4-d1
InChI	InChI=1S/C26H47NO20/c1-7-14(34)18(38)20(40)25(42-7)47-23-13(27-8(2)32)24(43-10(4-29)16(36)15(35)9(33)3-28)45-12(6-31)22(23)46-26-21(41)19(39)17(37)11(5-30)44-26/h7,9-26,28-31,33-41H,3-6H2,1-2H3,(H,27,32)/t7-,9+,10+,11+,12+,13+,14+,15+,16+,17-,18+,19-,20-,21+,22+,23+,24+,25-,26-/m0/s1
InChIKey	BXUWZGFEDDQXKP-GSDDEKDZSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(2R,3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(2R,3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:150368) is a oligosaccharide (CHEBI:50699)

Manual Xrefs	Databases
G38844QV	GlyTouCan