EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C40H43NO15 |
| Net Charge | 0 |
| Average Mass | 777.776 |
| Monoisotopic Mass | 777.26327 |
| SMILES | C/C=C(\C)C(=O)OC1C(O)CC(c2ccc3c(c2O)C(O)=C2C(=O)C4(OC)C(O)=C(C(N)=O)C(=O)C(OC(=O)c5ccccc5O)C4CC2C3(C)OC)OC1C |
| InChI | InChI=1S/C40H43NO15/c1-7-16(2)37(50)55-32-17(3)54-25(15-24(32)43)19-12-13-20-26(29(19)44)30(45)27-21(39(20,4)52-5)14-22-33(56-38(51)18-10-8-9-11-23(18)42)31(46)28(36(41)49)35(48)40(22,53-6)34(27)47/h7-13,17,21-22,24-25,32-33,42-45,48H,14-15H2,1-6H3,(H2,41,49)/b16-7+ |
| InChIKey | WYRYRHFKSQKGHJ-FRKPEAEDSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomycesspecies SF2575 (ncbitaxon:746675) | - | PubMed (1577661) |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| SF2575 (CHEBI:220202) is a tetracyclines (CHEBI:26895) |
| IUPAC Name |
|---|
| [3-carbamoyl-4,6,7-trihydroxy-8-[4-hydroxy-6-methyl-5-[(E)-2-methylbut-2-enoyl]oxyoxan-2-yl]-4a,11-dimethoxy-11-methyl-2,5-dioxo-1,11a,12,12a-tetrahydrotetracen-1-yl] 2-hydroxybenzoate |
| Manual Xrefs | Databases |
|---|---|
| 78444440 | ChemSpider |