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CHEBI:9470 - tetracenomycin C
| Formula | C23H20O11 |
| Net Charge | 0 |
| Average Mass | 472.402 |
| Monoisotopic Mass | 472.10056 |
| SMILES | COC(=O)c1c(OC)cc2cc3c(c(O)c2c1C)C(=O)[C@]1(O)C(=O)C=C(OC)[C@@H](O)[C@]1(O)C3=O |
| InChI | InChI=1S/C23H20O11/c1-8-14-9(6-11(32-2)15(8)21(29)34-4)5-10-16(17(14)25)20(28)22(30)13(24)7-12(33-3)19(27)23(22,31)18(10)26/h5-7,19,25,27,30-31H,1-4H3/t19-,22-,23-/m1/s1 |
| InChIKey | ULHJWHCSSAEMLW-UEVCKROQSA-N |
| Roles Classification |
|---|
| Biological Roles: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| tetracenomycin C (CHEBI:9470) is a methyl ester (CHEBI:25248) |
| tetracenomycin C (CHEBI:9470) is a tertiary α-hydroxy ketone (CHEBI:139592) |
| tetracenomycin C (CHEBI:9470) is a tetracenomycin (CHEBI:48132) |
| Incoming Relation(s) |
| 8-demethyl-8-(2-O-methyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78285) has functional parent tetracenomycin C (CHEBI:9470) |
| 8-demethyl-8-(2,3-O-dimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78286) has functional parent tetracenomycin C (CHEBI:9470) |
| 8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) has functional parent tetracenomycin C (CHEBI:9470) |
| 8-demethyl-8-(α-L-rhamnosyl)tetracenomycin C (CHEBI:78283) has functional parent tetracenomycin C (CHEBI:9470) |
| elloramycin A (CHEBI:78288) has functional parent tetracenomycin C (CHEBI:9470) |
| IUPAC Name |
|---|
| methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-6,6a,7,10,10a,11-hexahydrotetracene-2-carboxylate |
| Synonym | Source |
|---|---|
| Tetracenomycin C | KEGG COMPOUND |
| UniProt Name | Source |
|---|---|
| tetracenomycin C | UniProt |
| Manual Xrefs | Databases |
|---|---|
| C06801 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| Beilstein:4774234 | Beilstein |
| CAS:71135-22-3 | KEGG COMPOUND |
| CAS:71135-22-3 | ChemIDplus |