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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: | antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. 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) |
| 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 |