| SpectraBase Compound ID | 5wY8Y2hgr82 |
|---|---|
| InChI | InChI=1S/C31H33NO3/c1-19-16-27(34-5)30-24(12-9-13-26(30)33-4)28(19)25-15-14-23-17-20(2)32-21(3)29(23)31(25)35-18-22-10-7-6-8-11-22/h6-16,20-21,32H,17-18H2,1-5H3/t20-,21-/m1/s1 |
| InChIKey | FHALVTUCNXEXPF-NHCUHLMSSA-N |
| Mol Weight | 467.6 g/mol |
| Molecular Formula | C31H33NO3 |
| Exact Mass | 467.246044 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9YBPWU11BH1 |
|---|---|
| Name | 8-O-Benzyl-Dioncophylline A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H33NO3 |
| InChI | InChI=1S/C31H33NO3/c1-19-16-27(34-5)30-24(12-9-13-26(30)33-4)28(19)25-15-14-23-17-20(2)32-21(3)29(23)31(25)35-18-22-10-7-6-8-11-22/h6-16,20-21,32H,17-18H2,1-5H3/t20-,21-/m1/s1 |
| InChIKey | FHALVTUCNXEXPF-NHCUHLMSSA-N |
| Molecular Weight | 467.609 g/mol |
| SMILES | N1[C@@](Cc2ccc(c(c2[C@]1(C)[H])OCc1ccccc1)-c1c2c(c(OC)ccc2)c(cc1C)OC)(C)[H] |
| SPLASH | splash10-0udi-0002900000-804564d40ab2abb33d95 |
| Source of Spectrum | G4-60-346-15 |
| Synonyms | (1R,3R)-7-(4,5-dimethoxy-2-methyl-1-naphthalenyl)-1,3-dimethyl-8-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline (1R,3R)-7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-1,3-dimethyl-8-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline (1R,3R)-8-benzyloxy-7-(4,5-dimethoxy-2-methyl-1-naphthyl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline (1R,3R)-7-(4,5-dimethoxy-2-methyl-naphthalen-1-yl)-1,3-dimethyl-8-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline |
| Wiley ID | 1606658 |