MITOMYCIN ANALOG
[(4R,6R,7S,8R)-11-(3-hydroxypropylamino)-7-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Also Known As: MITOMYCIN ANALOG|[(4R,6R,7S,8R)-11-(3-hydroxypropylamino)-7-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate|{(1aR,8R,8aS,8bR)-6-[(3-Hydroxypropyl)amino]-8a-methoxy-1,5-dimethyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl}methyl carbamate|Azirino[2',4]pyrrolo[1,2-a]indole-4,7-dione, 8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,8,8a,8b-hexahydro-6-[(3-hydroxypropyl)amino]-8a-methoxy-1,5-dimethyl-, [1aR-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.)]-
| Molecular Formula | C19H26N4O6 |
|---|---|
| Molecular Weight | 406.18524 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 406.18524 |
| Monoisotopic Mass | 406.18524 |
| Heavy Atoms | 29 |
| Complexity | 852.0 |
Chemical Identifiers
| CAS Number | 78142-87-7 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@@H]4[C@H]([C@]3([C@H]2COC(=O)N)OC)N4C)NCCCO |
| InChIKey | MBNUEDJNTXWGMP-MHBRSWMOSA-N |
Product Overview
MITOMYCIN ANALOG (CAS 78142-87-7), with molecular formula C19H26N4O6 and molecular weight 406.18524 g/mol. IUPAC: [(4R,6R,7S,8R)-11-(3-hydroxypropylamino)-7-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate.
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