EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C69H115NO16P2 |
| Net Charge | 0 |
| Average Mass | 1276.618 |
| Monoisotopic Mass | 1275.76911 |
| SMILES | CC(=O)N[C@H]1C(OP(=O)(O)OP(=O)(O)OC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)O[C@H](CO)[C@@H](O[C@H]2O[C@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O |
| InChI | InChI=1S/C69H115NO16P2/c1-48(2)25-15-26-49(3)27-16-28-50(4)29-17-30-51(5)31-18-32-52(6)33-19-34-53(7)35-20-36-54(8)37-21-38-55(9)39-22-40-56(10)41-23-42-57(11)43-24-44-58(12)45-46-81-87(77,78)86-88(79,80)85-68-62(70-60(14)72)64(74)67(61(47-71)83-68)84-69-66(76)65(75)63(73)59(13)82-69/h25,27,29,31,33,35,37,39,41,43,45,59,61-69,71,73-76H,15-24,26,28,30,32,34,36,38,40,42,44,46-47H2,1-14H3,(H,70,72)(H,77,78)(H,79,80)/b49-27+,50-29+,51-31-,52-33-,53-35-,54-37-,55-39-,56-41-,57-43-,58-45-/t59-,61-,62-,63-,64-,65+,66+,67-,68?,69-/m1/s1 |
| InChIKey | ILEUMOHGJLLHBD-ZBMKVMBCSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-D-rhamnosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:62425) is a polyprenyl phospho oligosaccharide (CHEBI:26186) |
| α-D-rhamnosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:62425) is conjugate acid of α-D-rhamnosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2−) (CHEBI:62256) |
| Incoming Relation(s) |
| α-D-rhamnosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2−) (CHEBI:62256) is conjugate base of α-D-rhamnosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate (CHEBI:62425) |
| IUPAC Name |
|---|
| 2-acetamido-2-deoxy-4-O-(α-D-rhamnopyranosyl)-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose |
| Synonyms | Source |
|---|---|
| α-D-Rha-(1→4)-D-GlcNAc undecaprenyl diphosphate | ChEBI |
| α-D-Rhap-(1→4)-D-GlcpNAc undecaprenyl diphosphate | ChEBI |
| 2-acetamido-2-deoxy-4-O-(6-deoxy-α-D-mannopyranosyl)-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose | IUPAC |