| SpectraBase Spectrum ID |
FJUu8CRv9tP |
| Name |
Thebainone-A |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21NO3 |
| InChI |
InChI=1S/C18H21NO3/c1-19-8-7-18-10-12(20)4-5-13(18)14(19)9-11-3-6-15(22-2)17(21)16(11)18/h3-6,13-14,21H,7-10H2,1-2H3/t13-,14+,18-/m1/s1 |
| InChIKey |
SLJDAVMWFVYEFI-QWQRMKEZSA-N |
| Molecular Weight |
299.370 g/mol |
| SMILES |
Oc1c2[C@@]34[C@@]([C@](Cc2ccc1OC)(N(CC4)C)[H])(C=CC(C3)=O)[H] |
| SPLASH |
splash10-03fs-0951000000-da42ed7c897ca8fed94b |
| Source of Spectrum |
C-114-5966-43 |
| Synonyms |
(9alpha,13alpha,14alpha)-4-hydroxy-3-methoxy-17-methyl-7,8-didehydromorphinan-6-one |
| Wiley ID |
1302169 |
