EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C36H56O9 |
| Net Charge | 0 |
| Average Mass | 632.835 |
| Monoisotopic Mass | 632.39243 |
| SMILES | [H][C@]12CC=C3[C@]4([H])CC(C)(C)CC[C@]4(C(=O)O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@@]3(C)[C@]1(C)CC[C@]1([H])[C@]2(C)CC[C@H](O)[C@@]1(C)C=O |
| InChI | InChI=1S/C36H56O9/c1-31(2)13-15-36(30(43)45-29-28(42)27(41)26(40)22(18-37)44-29)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(39)33(4,19-38)23(32)9-12-35(24,34)6/h7,19,21-29,37,39-42H,8-18H2,1-6H3/t21-,22+,23+,24+,25-,26+,27-,28+,29+,32-,33-,34+,35+,36-/m0/s1 |
| InChIKey | JGTHNRAJDIUMIQ-UIJKDBGXSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| gypsogenin 28-β-D-glucoside (CHEBI:167133) has functional parent gypsogenin (CHEBI:5580) |
| gypsogenin 28-β-D-glucoside (CHEBI:167133) is a monosaccharide derivative (CHEBI:63367) |
| gypsogenin 28-β-D-glucoside (CHEBI:167133) is a β-D-glucoside (CHEBI:22798) |
| UniProt Name | Source |
|---|---|
| gypsogenin 28-β-D-glucoside | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-9472 | MetaCyc |
| Citations |
|---|