![3-Hydroxy-13[S],14,15-dinorlabd-8(17)-ene 13-(p-methoxyphenyl)acetate](/api/spectrum/4tUsI8GDiKN/structure.png?h=300&w=458 "3-Hydroxy-13[S],14,15-dinorlabd-8(17)-ene 13-(p-methoxyphenyl)acetate")
| SpectraBase Compound ID | ETrItCyjMkE |
|---|---|
| InChI | InChI=1S/C27H40O4/c1-18-7-14-23-26(3,4)24(28)15-16-27(23,5)22(18)13-8-19(2)31-25(29)17-20-9-11-21(30-6)12-10-20/h9-12,19,22-24,28H,1,7-8,13-17H2,2-6H3/t19?,22-,23-,24-,27+/m1/s1 |
| InChIKey | SFSKSTUHPXEHBY-DJMYSZGFSA-N |
| Mol Weight | 428.6 g/mol |
| Molecular Formula | C27H40O4 |
| Exact Mass | 428.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4tUsI8GDiKN |
|---|---|
| Name | 3-Hydroxy-13[S],14,15-dinorlabd-8(17)-ene 13-(p-methoxyphenyl)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 428.292659764 u |
| Formula | C27H40O4 |
| InChI | InChI=1S/C27H40O4/c1-18-7-14-23-26(3,4)24(28)15-16-27(23,5)22(18)13-8-19(2)31-25(29)17-20-9-11-21(30-6)12-10-20/h9-12,19,22-24,28H,1,7-8,13-17H2,2-6H3/t19?,22-,23-,24-,27+/m1/s1 |
| InChIKey | SFSKSTUHPXEHBY-DJMYSZGFSA-N |
| Molecular Weight | 428.613 g/mol |
| SMILES | [C@]12([C@@](C([C@](O)(CC2)[H])(C)C)(CCC([C@]1(CCC(OC(=O)CC1=CC=C(C=C1)OC)C)[H])=C)[H])C |