| SpectraBase Compound ID | 9Yt7JXdTky1 |
|---|---|
| InChI | InChI=1S/C30H50O3/c1-25(2)14-15-30(18-31)20(16-25)19-8-9-22-27(5)12-11-23(32)26(3,4)21(27)10-13-28(22,6)29(19,7)17-24(30)33/h8,20-24,31-33H,9-18H2,1-7H3/t20-,21-,22+,23-,24+,27-,28+,29+,30+/m0/s1 |
| InChIKey | YHGVYECWZWIVJC-TVZJSHMMSA-N |
| Mol Weight | 458.7 g/mol |
| Molecular Formula | C30H50O3 |
| Exact Mass | 458.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CDY8fBeB4Jr |
|---|---|
| Name | PRIMULAGENIN-A;3-BETA,16-ALPHA,28-TRIHYDROXY-12-OLEANENE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O3 |
| InChI | InChI=1S/C30H50O3/c1-25(2)14-15-30(18-31)20(16-25)19-8-9-22-27(5)12-11-23(32)26(3,4)21(27)10-13-28(22,6)29(19,7)17-24(30)33/h8,20-24,31-33H,9-18H2,1-7H3/t20-,21-,22+,23-,24+,27-,28+,29+,30+/m0/s1 |
| InChIKey | YHGVYECWZWIVJC-TVZJSHMMSA-N |
| Literature Reference Author | A.K.MACHOCHO,P.C.KIPRONO,S.GRINBERG,S.BITTNER |
| Literature Reference Citation | PHYTOCHEM.,62,573(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00619-2 |
| Molecular Weight | 458.725 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN26861 |