EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C31H47NO10 |
| Net Charge | 0 |
| Average Mass | 593.714 |
| Monoisotopic Mass | 593.32000 |
| SMILES | COc1nc(C/C=C(\C)C/C=C/C(C)=C/C(C)C(OC2OC(CO)C(O)C(O)C2O)/C(C)=C/CO)c(C)c(=O)c1OC |
| InChI | InChI=1S/C31H47NO10/c1-17(11-12-22-21(5)24(35)29(39-6)30(32-22)40-7)9-8-10-18(2)15-20(4)28(19(3)13-14-33)42-31-27(38)26(37)25(36)23(16-34)41-31/h8,10-11,13,15,20,23,25-28,31,33-34,36-38H,9,12,14,16H2,1-7H3,(H,32,35)/b10-8+,17-11+,18-15+,19-13+ |
| InChIKey | ZNDBGWYPOYJCKZ-RGGUUVRDSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (2258331) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 13-Hydroxyglucopiericidin A (CHEBI:205209) is a terpene glycoside (CHEBI:61777) |
| IUPAC Name |
|---|
| 2-[(2E,5E,7E,11E)-13-hydroxy-3,7,9,11-tetramethyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one |
| Manual Xrefs | Databases |
|---|---|
| 78444103 | ChemSpider |