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CHEBI:153941 - N-[(3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-5-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide

ChEBI IDCHEBI:153941
ChEBI NameN-[(3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-5-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC26H45NO20
Net Charge0
Average Mass691.633
Monoisotopic Mass691.25349
SMILESCC(=O)N[C@H]1C(O[C@@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1OC1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/4,4,3/[a1122h-1x_1-5][a2122h-1x_1-5_2*NCC/3=O][a1221m-1x_1-5][a2112h-1x_1-5]/1-2-3-4/a2-b1_b3-c1_b4-d1
InChIInChI=1S/C26H45NO20/c1-6-12(32)15(35)18(38)25(41-6)46-21-11(27-7(2)31)24(47-22-17(37)14(34)8(3-28)42-23(22)40)44-10(5-30)20(21)45-26-19(39)16(36)13(33)9(4-29)43-26/h6,8-26,28-30,32-40H,3-5H2,1-2H3,(H,27,31)/t6-,8+,9+,10+,11+,12+,13-,14+,15+,16-,17-,18-,19+,20+,21+,22-,23?,24?,25?,26?/m0/s1
InChIKeyLWBVOUDVERIYGS-XZDPRDRFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(3R,4R,5S,6R)-6-(Hydroxymethyl)-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-5-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:153941) is a oligosaccharide (CHEBI:50699)
Synonyms  Source
6-deoxy-L-galacto-hexopyranosyl-(1->3)-[D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-D-gluco-hexopyranosyl-(1->2)-D-manno-hexopyranoseSUBMITTER
Fuc(?1-3)[Gal(?1-4)]GlcNAc(?1-2)ManSUBMITTER
Manual XrefsDatabases
G81023KTGlyTouCan
G81023KTGlyGen