| SpectraBase Compound ID | EfqIoRE0Sn7 |
|---|---|
| InChI | InChI=1S/C29H42O4/c1-19(10-11-21-16-23(32-7)15-20(2)25(21)33-8)14-22-17-28(5)12-9-13-29(28,6)26(30)24(22)18-27(3,4)31/h10,15-16,31H,9,11-14,17-18H2,1-8H3/b19-10+/t28-,29+/m1/s1 |
| InChIKey | JJJJTQJVJRHYKV-UMPJSDBQSA-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 | JYYehwZWe90 |
|---|---|
| Name | CYSTALGERONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O4 |
| InChI | InChI=1S/C29H42O4/c1-19(10-11-21-16-23(32-7)15-20(2)25(21)33-8)14-22-17-28(5)12-9-13-29(28,6)26(30)24(22)18-27(3,4)31/h10,15-16,31H,9,11-14,17-18H2,1-8H3/b19-10+/t28-,29+/m1/s1 |
| InChIKey | JJJJTQJVJRHYKV-UMPJSDBQSA-N |
| Literature Reference Author | V.AMICO,M.PIATTELLI,P.NERI,M.RECUPERO |
| Literature Reference Citation | J.NAT.PROD.,54,877(1991) |
| Literature Reference DOI | 10.1021/np50075a024 |
| Molecular Weight | 454.650 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS15671 |