MITOMYCIN ANALOG
[(4R,6R,7S,8R)-7-methoxy-12-methyl-11-(2-methylprop-2-enylamino)-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|Azirino[2',4]pyrrolo[1,2-a]indole-4,7-dione, 8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,8,8a,8b-hexahydro-8a-methoxy-5-methyl-6-[(2-methyl-2-propenyl)amino]-, (1aR-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.))-|Azirino[2',4]pyrrolo[1,2-a]indole-4,7-dione, 8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,8,8a,8b-hexahydro-8a-methoxy-5-methyl-6-[(2-methyl-2-propenyl)amino]-, [1aR-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.)]-
| Molecular Formula | C19H24N4O5 |
|---|---|
| Molecular Weight | 388.17468 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.17468 |
| Monoisotopic Mass | 388.17468 |
| Heavy Atoms | 28 |
| Complexity | 876.0 |
Chemical Identifiers
| CAS Number | 78142-77-5 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@@H]4[C@H]([C@]3([C@H]2COC(=O)N)OC)N4)NCC(=C)C |
| InChIKey | FKSQDPMQAXFDLW-WPTVWNQNSA-N |
Product Overview
MITOMYCIN ANALOG (CAS 78142-77-5), with molecular formula C19H24N4O5 and molecular weight 388.17468 g/mol. IUPAC: [(4R,6R,7S,8R)-7-methoxy-12-methyl-11-(2-methylprop-2-enylamino)-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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