![(4aS*,11aS*)-4a-Hydroxy-8-isopropyl-6,7,9-trimethoxy-1,1-dimethyl-1,2,3,4,4a,5,11,11a-octahydrodibenzo[a,d]cyclohepten-10-one](/api/spectrum/U1ew0P4PTg/structure.png?h=300&w=458 "(4aS*,11aS*)-4a-Hydroxy-8-isopropyl-6,7,9-trimethoxy-1,1-dimethyl-1,2,3,4,4a,5,11,11a-octahydrodibenzo[a,d]cyclohepten-10-one")
| SpectraBase Compound ID | 9gE61oZuM9G |
|---|---|
| InChI | InChI=1S/C23H34O5/c1-13(2)17-20(27-6)18-14(19(26-5)21(17)28-7)12-23(25)10-8-9-22(3,4)16(23)11-15(18)24/h13,16,25H,8-12H2,1-7H3/t16-,23-/m0/s1 |
| InChIKey | WAOGUCABBIJGPT-HJPURHCSSA-N |
| Mol Weight | 390.5 g/mol |
| Molecular Formula | C23H34O5 |
| Exact Mass | 390.240624 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | U1ew0P4PTg |
|---|---|
| Name | (4aS*,11aS*)-4a-Hydroxy-8-isopropyl-6,7,9-trimethoxy-1,1-dimethyl-1,2,3,4,4a,5,11,11a-octahydrodibenzo[a,d]cyclohepten-10-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H34O5 |
| InChI | InChI=1S/C23H34O5/c1-13(2)17-20(27-6)18-14(19(26-5)21(17)28-7)12-23(25)10-8-9-22(3,4)16(23)11-15(18)24/h13,16,25H,8-12H2,1-7H3/t16-,23-/m0/s1 |
| InChIKey | WAOGUCABBIJGPT-HJPURHCSSA-N |
| Molecular Weight | 390.520 g/mol |
| SMILES | O[C@]12Cc3c(c(c(c(OC)c3OC)C(C)C)OC)C(C[C@]2(C(CCC1)(C)C)[H])=O |
| SPLASH | splash10-0udl-0096000000-92746c1552c98a4e2708 |
| Source of Spectrum | F-70-7699-5 |
| Synonyms | (4aS,11aS)-4a-hydroxy-8-isopropyl-6,7,9-trimethoxy-1,1-dimethyl-1,2,3,4,4a,5,11,11a-octahydro-10H-dibenzo[a,d]cyclohepten-10-one (6aS,10aS)-10a-hydroxy-1,2,4-trimethoxy-7,7-dimethyl-3-propan-2-yl-6,6a,8,9,10,11-hexahydrodibenzo[3,1-d:6',5'-e][7]annulen-5-one (6aS,10aS)-10a-hydroxy-3-isopropyl-1,2,4-trimethoxy-7,7-dimethyl-6,6a,8,9,10,11-hexahydrodibenzo[3,1-d:6',5'-e][7]annulen-5-one (6aS,10aS)-1,2,4-trimethoxy-7,7-dimethyl-10a-oxidanyl-3-propan-2-yl-6,6a,8,9,10,11-hexahydrodibenzo[3,1-d:6',5'-e][7]annulen-5-one |
| Wiley ID | 1597544 |