Leurosine-N'(b)-oxide
methyl 11-acetyloxy-4-(13-acetyloxy-18-ethyl-1-oxido-17-oxa-11-aza-1-azoniapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-13-yl)-12-ethyl-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
Also Known As: Leurosine-N'(b)-oxide|Methyl 4-(acetyloxy)-15-[11-(acetyloxy)-1a-ethyl-3-oxo-1a,2,3,4,5,10,11,12,13,13a-decahydro-3,13-methano-3lambda~5~-oxireno[9,10]azacycloundecino[5,4-b]indol-11-yl]-3-hydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate
| Molecular Formula | C46H56N4O10 |
|---|---|
| Molecular Weight | 824.39966 g/mol |
| LogP | 4.3675 |
| Topological Polar Surface Area | 166.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 824.39966 |
| Monoisotopic Mass | 824.39966 |
| Heavy Atoms | 60 |
| Complexity | 2364.7776 |
Chemical Identifiers
| CAS Number | 39608-80-5 |
|---|---|
| SMILES | CCC12C[N+]3(CCC4=C(C(CC(C3)C1O2)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)OC(=O)C)NC1=CC=CC=C41)[O-] |
Product Overview
Leurosine-N'(b)-oxide (CAS 39608-80-5), with molecular formula C46H56N4O10 and molecular weight 824.39966 g/mol. IUPAC: methyl 11-acetyloxy-4-(13-acetyloxy-18-ethyl-1-oxido-17-oxa-11-aza-1-azoniapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-13-yl)-12-ethyl-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate.
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