EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C29H51NO22 |
| Net Charge | 0 |
| Average Mass | 765.712 |
| Monoisotopic Mass | 765.29027 |
| SMILES | NCCCCCO[C@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O[C@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C29H51NO22/c30-4-2-1-3-5-45-26-19(41)16(38)21(10(7-32)47-26)49-29-20(42)23(51-28-18(40)14(36)15(37)24(52-28)25(43)44)22(11(8-33)48-29)50-27-17(39)13(35)12(34)9(6-31)46-27/h9-24,26-29,31-42H,1-8,30H2,(H,43,44)/t9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20+,21-,22-,23-,24+,26+,27+,28+,29+/m1/s1 |
| InChIKey | DABVOFBSAZSWSN-DLZRWJADSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-Glcp-(1→4)-[α-D-GlcpA-(1→3)]-β-D-Manp-(1→4)-α-D-GlcpO[CH2]5NH2 (CHEBI:166910) has functional parent β-D-Glcp-(1→4)-[α-D-GlcpA-(1→3)]-β-D-Manp-(1→4)-α-D-Glcp (CHEBI:166911) |
| β-D-Glcp-(1→4)-[α-D-GlcpA-(1→3)]-β-D-Manp-(1→4)-α-D-GlcpO[CH2]5NH2 (CHEBI:166910) is a tetrasaccharide derivative (CHEBI:63567) |
| β-D-Glcp-(1→4)-[α-D-GlcpA-(1→3)]-β-D-Manp-(1→4)-α-D-GlcpO[CH2]5NH2 (CHEBI:166910) is a α-D-glucoside (CHEBI:22390) |
| IUPAC Name |
|---|
| 5-aminopentyl β-D-glucopyranosyl-(1→4)-[α-D-glucopyranuronosyl-(1→3)]-β-D-mannopyranosyl-(1→4)-α-D-glucopyranoside |
| Synonyms | Source |
|---|---|
| 5-aminopentyl β-D-glucosyl-(1→4)-[α-D-glucuronosyl-(1→3)]-β-D-mannosyl-(1→4)-α-D-glucoside | ChEBI |
| β-D-Glc-(1→4)-[α-D-GlcA-(1→3)]-β-D-Man-(1→4)-α-D-GlcO[CH2]5NH2 | ChEBI |
| Glcβ1-4(GlcAα1-4)Manβ1-4GlcαO[CH2]5NH2 | ChEBI |
| Citations |
|---|