For research use only. Not for therapeutic Use.
| Catalog Number | M108247 |
| CAS Number | 138967-27-8 |
| Synonyms | N-(5,5-diacetoxypentyl)doxorubicin |
| Molecular Formula | C36H43NO15 |
| Purity | ≥95% |
| Storage | Desiccate at +4C |
| IUPAC Name | [1-acetyloxy-5-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]amino]pentyl] acetate |
| InChI | InChI=1S/C36H43NO15/c1-16-31(42)21(37-11-6-5-10-25(50-17(2)39)51-18(3)40)12-26(49-16)52-23-14-36(47,24(41)15-38)13-20-28(23)35(46)30-29(33(20)44)32(43)19-8-7-9-22(48-4)27(19)34(30)45/h7-9,16,21,23,25-26,31,37-38,42,44,46-47H,5-6,10-15H2,1-4H3/t16-,21-,23-,26-,31+,36-/m0/s1 |
| InChIKey | RBQJFBGSQDDJKT-YTHWRKCVSA-N |
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)NCCCCC(OC(=O)C)OC(=O)C)O |
