| SpectraBase Compound ID | FnS4K0pdu8v |
|---|---|
| InChI | InChI=1S/C23H25NO4/c1-12-9-14-7-8-17(23(27)20(14)13(2)24-12)21-15(11-25)10-19(28-3)22-16(21)5-4-6-18(22)26/h4-8,10,12-13,24-27H,9,11H2,1-3H3/t12-,13-/m1/s1 |
| InChIKey | ZQSUAGVTKAZDJV-CHWSQXEVSA-N |
| Mol Weight | 379.46 g/mol |
| Molecular Formula | C23H25NO4 |
| Exact Mass | 379.178358 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ldaSxNVOXH |
|---|---|
| Name | Dioncopeltine A |
| Alternate Name(s) | (1R,3R)-7-(5-hydroxy-4-methoxy-2-methylol-1-naphthyl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol (1R,3R)-7-[2-(hydroxymethyl)-4-methoxy-5-oxidanyl-naphthalen-1-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol (1R,3R)-7-[5-hydroxy-2-(hydroxymethyl)-4-methoxy-1-naphthalenyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol (1R,3R)-7-[5-hydroxy-2-(hydroxymethyl)-4-methoxy-1-naphthyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol (1R,3R)-7-[5-hydroxy-2-(hydroxymethyl)-4-methoxynaphthalen-1-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H25NO4 |
| InChI | InChI=1S/C23H25NO4/c1-12-9-14-7-8-17(23(27)20(14)13(2)24-12)21-15(11-25)10-19(28-3)22-16(21)5-4-6-18(22)26/h4-8,10,12-13,24-27H,9,11H2,1-3H3/t12-,13-/m1/s1 |
| InChIKey | ZQSUAGVTKAZDJV-CHWSQXEVSA-N |
| Molecular Weight | 379.456 g/mol |
| SMILES | N1[C@@](Cc2c(c(c(-c3c(CO)cc(c4c3cccc4O)OC)cc2)O)[C@]1(C)[H])(C)[H] |
| SPLASH | splash10-03di-0009000000-5ec0a611dcc83eed9f5f |
| Source of Spectrum | F-55-429-5 |
| Wiley ID | 836452 |