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CHEBI:214391 - Dactylocycline B
| Formula | C31H38ClN3O14 |
| Net Charge | 0 |
| Average Mass | 712.105 |
| Monoisotopic Mass | 711.20423 |
| SMILES | COc1cc(O)c2c(c1Cl)C(C)(OC1CC(C)([N+](=O)[O-])C(OC)C(C)O1)C1CC3(O)C(N(C)C)C(=O)C(C(N)=O)=C(O)C3(O)C(=O)C1=C2O |
| InChI | InChI=1S/C31H38ClN3O14/c1-11-26(47-7)28(2,35(44)45)10-15(48-11)49-29(3)12-9-30(42)23(34(4)5)22(38)18(27(33)41)25(40)31(30,43)24(39)16(12)21(37)17-13(36)8-14(46-6)20(32)19(17)29/h8,11-12,15,23,26,36-37,40,42-43H,9-10H2,1-7H3,(H2,33,41) |
| InChIKey | TZTDHPHRCVMDBT-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Dactylosporangiumspecies (ncbitaxon:60453) | - | PubMed (1490880) |
| 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) |
| Dactylocycline B (CHEBI:214391) is a tetracyclines (CHEBI:26895) |
| IUPAC Name |
|---|
| 7-chloro-4-(dimethylamino)-1,4a,10,11,12a-pentahydroxy-8-methoxy-6-(5-methoxy-4,6-dimethyl-4-nitrooxan-2-yl)oxy-6-methyl-3,12-dioxo-5,5a-dihydro-4H-tetracene-2-carboxamide |
| Manual Xrefs | Databases |
|---|---|
| 78444170 | ChemSpider |