Doxorubicinolone
Request a quoteCatalog Number | ACM56149236 |
Product Name | Doxorubicinolone |
CAS Number | 56149-23-6 |
Structure | |
IUPAC Name | (7S,9S)-9-[(1S)-1,2-dihydroxyethyl]-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione |
Synonyms | Adriamycinol Aglycone |
Molecular Weight | 416.38 |
Molecular Formula | C21H20O9 |
Canonical SMILES | COC1=CC=CC2=C1C(=O)C3=C(C4=C(C[C@](C[C@@H]4O)([C@H](CO)O)O)C(=C3C2=O)O)O |
Inchi | InChI=1S/C21H20O9/c1-30-11-4-2-3-8-14(11)20(28)16-15(17(8)25)18(26)9-5-21(29,12(24)7-22)6-10(23)13(9)19(16)27/h2-4,10,12,22-24,26-27,29H,5-7H2,1H3/t10-,12-,21-/m0/s1 |
InChIKey | CGVVIRBOJFDFBH-FPQVQZPGSA-N |
Boiling Point | 748.6 °C at 760 mmHg (Predicted) |
Melting Point | 192-197 °C |
Flash Point | 267.5±26.4 °C |
Purity | 96% |
Density | 1.7 g/cm3(Predicted) |
Appearance | Red Solid |
Refractive Index | 1.745 |
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