EMBL-EBI | Chemical Biology | ChEBI
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| Formula | HCl.C34H35N3O10 |
| Net Charge | 0 |
| Average Mass | 682.126 |
| Monoisotopic Mass | 681.20892 |
| SMILES | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/NC(=O)c1ccccc1)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.Cl |
| InChI | InChI=1S/C34H35N3O10.ClH/c1-15-28(38)20(35)12-23(46-15)47-22-14-34(44,16(2)36-37-33(43)17-8-5-4-6-9-17)13-19-25(22)32(42)27-26(30(19)40)29(39)18-10-7-11-21(45-3)24(18)31(27)41;/h4-11,15,20,22-23,28,38,40,42,44H,12-14,35H2,1-3H3,(H,37,43);1H/b36-16+;/t15-,20-,22-,23-,28+,34-;/m0./s1 |
| InChIKey | NKFHKYQGZDAKMX-PPRKPIOESA-N |
| 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) |
| zorubicin hydrochloride (CHEBI:751620) is a anthracycline (CHEBI:48120) |
| Synonyms | Source |
|---|---|
| NSC-164011 | ChEMBL |
| RP 22,050 HYDROCHLORIDE | ChEMBL |
| RP-22050 HYDROCHLORIDE | ChEMBL |
| Zorubicin hcl | ChEMBL |
| Zorubicin hydrochloride | ChEMBL |
| Citations |
|---|