| SpectraBase Compound ID | 2OIFZlRTbbd |
|---|---|
| InChI | InChI=1S/C29H42O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h15,21-22,30-31H,7-14,16H2,1-6H3,(H,32,33)/t21?,22-,25-,26-,27+,28-,29+/m1/s1 |
| InChIKey | NBMIXMLIGPLJPK-BNRLVEOXSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C29H42O4 |
| Exact Mass | 454.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GKKnkgLAP07 |
|---|---|
| Name | WILFORIC-ACID-A;2,3-DIHYDROXY-24-NOR-D:A-FRIEDOOLEAN-1,3,5(10)-TRIENE-29-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O4 |
| InChI | InChI=1S/C29H42O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h15,21-22,30-31H,7-14,16H2,1-6H3,(H,32,33)/t21?,22-,25-,26-,27+,28-,29+/m1/s1 |
| InChIKey | NBMIXMLIGPLJPK-BNRLVEOXSA-N |
| Literature Reference Author | K.LI,H.DUAN,K.KAWAZOE,Y.TAKAISHI |
| Literature Reference Citation | PHYTOCHEM.,45,791(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00048-4 |
| Molecular Weight | 454.650 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSP1562 |