| SpectraBase Compound ID | 9GBPoiBMJu2 |
|---|---|
| InChI | InChI=1S/C30H52O2/c1-25(2)19-11-17-29(7)21(27(19,5)15-13-23(25)31)9-10-22-28(6)16-14-24(32)26(3,4)20(28)12-18-30(22,29)8/h19-24,31-32H,9-18H2,1-8H3/t19-,20?,21+,22?,23-,24-,27-,28-,29+,30+/m0/s1 |
| InChIKey | QIRODTHVSNBDCB-OPEMEOOXSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C30H52O2 |
| Exact Mass | 444.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7xYnVxtRrTl |
|---|---|
| Name | GAMMACERAN-3-BETA,21-ALPHA-DIOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O2 |
| InChI | InChI=1S/C30H52O2/c1-25(2)19-11-17-29(7)21(27(19,5)15-13-23(25)31)9-10-22-28(6)16-14-24(32)26(3,4)20(28)12-18-30(22,29)8/h19-24,31-32H,9-18H2,1-8H3/t19-,20?,21+,22?,23-,24-,27-,28-,29+,30+/m0/s1 |
| InChIKey | QIRODTHVSNBDCB-OPEMEOOXSA-N |
| Literature Reference Author | R.TANAKA,T.MIZOTA,S.MATSUNAGA |
| Literature Reference Citation | J.NAT.PROD.,57,761(1994) |
| Literature Reference DOI | 10.1021/np50108a012 |
| Molecular Weight | 444.742 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1851 |