| SpectraBase Compound ID | Jx3km8sTqbf |
|---|---|
| InChI | InChI=1S/C35H38N2O6/c1-40-32-9-6-22(15-29-27-20-31(39)34(42-3)18-24(27)11-13-37-29)16-35(32)43-25-7-4-21(5-8-25)14-28-26-19-30(38)33(41-2)17-23(26)10-12-36-28/h4-9,16-20,28-29,36-39H,10-15H2,1-3H3/t28-,29-/m1/s1 |
| InChIKey | DLKOEMSGKYGCFE-FQLXRVMXSA-N |
| Mol Weight | 582.7 g/mol |
| Molecular Formula | C35H38N2O6 |
| Exact Mass | 582.272987 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FU7il2VXbNP |
|---|---|
| Name | Costaricine |
| Alternate Name(s) | (1R)-1-[[4-[5-[[(1R)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (1R)-1-[[4-[5-[[(1R)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-methoxy-phenoxy]phenyl]methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (1R)-6-methoxy-1-[[4-[2-methoxy-5-[[(1R)-6-methoxy-7-oxidanyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]phenoxy]phenyl]methyl]-1,2,3,4-tetrahydroisoquinolin-7-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H38N2O6 |
| InChI | InChI=1S/C35H38N2O6/c1-40-32-9-6-22(15-29-27-20-31(39)34(42-3)18-24(27)11-13-37-29)16-35(32)43-25-7-4-21(5-8-25)14-28-26-19-30(38)33(41-2)17-23(26)10-12-36-28/h4-9,16-20,28-29,36-39H,10-15H2,1-3H3/t28-,29-/m1/s1 |
| InChIKey | DLKOEMSGKYGCFE-FQLXRVMXSA-N |
| Molecular Weight | 582.697 g/mol |
| SMILES | Oc1cc2[C@@](Cc3ccc(Oc4cc(C[C@@]5(c6cc(O)c(cc6CCN5)OC)[H])ccc4OC)cc3)(NCCc2cc1OC)[H] |
| SPLASH | splash10-004i-0900000000-91c3b75a7a3d1e470a24 |
| Source of Spectrum | G4-60-940-0 |
| Wiley ID | 1606854 |