(+)-Cocsoline
27-methoxy-22-methyl-15,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.216,19.14,30.110,14.03,8.025,33.028,32]heptatriaconta-1(30),2,4(34),10(37),11,13,16,18,25,27,32,35-dodecaen-13-ol
Also Known As: (+)-Cocsoline|Halomicin B|6-Methoxy-2-methyl-6',7-epoxyoxyacanthan-12'-ol|Oxyacanthan-12'-ol, 6',7-epoxy-6-methoxy-2-methyl-, (1'alpha)-|2-Propenamide,N-[4-[(difluoromethyl)thio]phenyl]-2-methyl
| Molecular Formula | C34H32N2O5 |
|---|---|
| Molecular Weight | 548.23114 g/mol |
| LogP | 6.6057 |
| Topological Polar Surface Area | 72.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 548.23114 |
| Monoisotopic Mass | 548.23114 |
| Heavy Atoms | 41 |
| Complexity | 1682.2633 |
Chemical Identifiers
| CAS Number | 54352-70-4 |
|---|---|
| SMILES | CN1CCC2=CC(=C3C4=C2C1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)CC7C8=CC(=C(O3)C=C8CCN7)O4)O)OC |
Product Overview
(+)-Cocsoline (CAS 54352-70-4), with molecular formula C34H32N2O5 and molecular weight 548.23114 g/mol. IUPAC: 27-methoxy-22-methyl-15,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.216,19.14,30.110,14.03,8.025,33.028,32]heptatriaconta-1(30),2,4(34),10(37),11,13,16,18,25,27,32,35-dodecaen-13-ol.
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