| SpectraBase Compound ID | 8wFILQKHa1r |
|---|---|
| InChI | InChI=1S/C27H36O4/c1-24(2)20(28)10-11-26(4)22(24)19(31-23(30)17-8-6-5-7-9-17)14-18-15-21(29)25(3)12-13-27(18,26)16-25/h5-9,18-20,22,28H,10-16H2,1-4H3/t18-,19+,20-,22-,25-,26-,27-/m0/s1 |
| InChIKey | GHPIXCFNRDYEIY-GOBAYKAJSA-N |
| Mol Weight | 424.6 g/mol |
| Molecular Formula | C27H36O4 |
| Exact Mass | 424.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7O5zZ24DH5l |
|---|---|
| Name | ISO-DULCINOL;3-BETA-HYDROXY-6-BETA-BENZOYL-12-METHYL-9(12)(A),9(12)(B)-DIHOMOPODOCARPANE-13-ONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36O4 |
| InChI | InChI=1S/C27H36O4/c1-24(2)20(28)10-11-26(4)22(24)19(31-23(30)17-8-6-5-7-9-17)14-18-15-21(29)25(3)12-13-27(18,26)16-25/h5-9,18-20,22,28H,10-16H2,1-4H3/t18-,19+,20-,22-,25-,26-,27-/m0/s1 |
| InChIKey | GHPIXCFNRDYEIY-GOBAYKAJSA-N |
| Literature Reference Author | M.AHSAN,S.N.ISLAM,A.I.GRAY,W.H.STIMSON |
| Literature Reference Citation | J.NAT.PROD.,66,958(2003) |
| Literature Reference DOI | 10.1021/np020356j |
| Molecular Weight | 424.580 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP89 |