| SpectraBase Compound ID | 6RFTr23dQjh |
|---|---|
| InChI | InChI=1S/C29H42O3/c1-24(2)19-9-12-27(5)20(26(19,4)11-10-22(24)30)8-7-17-18-15-25(3)13-14-29(18,23(31)32)21(25)16-28(17,27)6/h7,18-21H,8-16H2,1-6H3,(H,31,32)/t18-,19+,20-,21+,25-,26+,27-,28-,29-/m1/s1 |
| InChIKey | HYPWOKYAFCFTTN-GOKNWNGASA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C29H42O3 |
| Exact Mass | 438.313395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJWgLdNbP3X |
|---|---|
| Name | 11-DEOXO-PULVERIC-ACID;3-OXO-PFAFFAN-12-ENE-28-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O3 |
| InChI | InChI=1S/C29H42O3/c1-24(2)19-9-12-27(5)20(26(19,4)11-10-22(24)30)8-7-17-18-15-25(3)13-14-29(18,23(31)32)21(25)16-28(17,27)6/h7,18-21H,8-16H2,1-6H3,(H,31,32)/t18-,19+,20-,21+,25-,26+,27-,28-,29-/m1/s1 |
| InChIKey | HYPWOKYAFCFTTN-GOKNWNGASA-N |
| Literature Reference Author | Y.SHIOBARA,S.S.INOUE,Y.NISHIGUCHI,K.KATO,T.TAKEMOTO,N.NISHIM OTO,F.D.OLIVEIRA,G.A |
| Literature Reference Citation | PHYTOCHEM.,31,1737(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83138-O |
| Molecular Weight | 438.651 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6005 |