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CHEBI:154774 - N-[(2S,3R,4S,5R)-4-[(2S,3S,4S,5R,6R)-6-[[(2S,3S,4S,5R,6R)-3,5-Dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide
| Formula | C38H67NO31 |
| Net Charge | 0 |
| Average Mass | 1033.930 |
| Monoisotopic Mass | 1033.36970 |
| SMILES | CC(=O)N[C@@H](CO)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO[C@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O)[C@H](O)CO |
| WURCS | WURCS=2.0/3,6,5/[h2122h_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-2-3-3-3-3/a4-b1_b3-c1_b6-d1_d3-e1_d6-f1 |
| InChI | InChI=1S/C38H67NO31/c1-9(45)39-10(2-40)17(47)31(11(46)3-41)68-38-30(60)33(70-37-28(58)25(55)20(50)14(6-44)65-37)22(52)16(67-38)8-62-35-29(59)32(69-36-27(57)24(54)19(49)13(5-43)64-36)21(51)15(66-35)7-61-34-26(56)23(53)18(48)12(4-42)63-34/h10-38,40-44,46-60H,2-8H2,1H3,(H,39,45)/t10-,11+,12+,13+,14+,15+,16+,17+,18+,19+,20+,21+,22+,23-,24-,25-,26-,27-,28-,29-,30-,31+,32-,33-,34-,35-,36+,37+,38-/m0/s1 |
| InChIKey | LXOONZCMANVIDP-FKEFCVAWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R,4S,5R)-4-[(2S,3S,4S,5R,6R)-6-[[(2S,3S,4S,5R,6R)-3,5-Dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide (CHEBI:154774) is a oligosaccharide (CHEBI:50699) |