| SpectraBase Spectrum ID |
J3IENPuepKi |
| Name |
(-)-Roehybrine |
| CAS Registry Number |
52705-95-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H25NO4 |
| InChI |
InChI=1S/C19H25NO4/c1-10-6-12-16-11(10)7-19(5-4-13(21)14(8-19)23-2)18(22)17(16)15(24-3)9-20-12/h9-11,14,20,22H,4-8H2,1-3H3 |
| InChIKey |
LPMIUKMLJRRUMG-UHFFFAOYSA-N |
| Molecular Weight |
331.412 g/mol |
| SMILES |
OC=1C2(CC3C(CC4=C3C1C(=CN4)OC)C)CC(OC)C(CC2)=O |
| SPLASH |
splash10-001r-6497000000-309249a8ba9890f1f09c |
| Source of Spectrum |
CD-104-0-0 |
| Synonyms |
Roehybrine
7'-hydroxy-3,9'-dimethoxy-3'-methyl-11'-azaspiro[cyclohexane-1,6'-tricyclo[6.3.1.0(4,12)]dodecane]-1'(12'),7',9'-trien-4-one
Rehybrine
Spiro[cyclohexane-1,7'(1'H)-cyclopent[ij]isoquinolin]-4-one, 2',3',8',8'a-tetrahydro-6'-hydroxy-3,5'-dimethoxy-1'-methyl-, [7'R-[7'.alpha.(S*),8'a.alpha.]]- |
| Wiley ID |
1328751 |
