| SpectraBase Compound ID | 5LjofUK56bv |
|---|---|
| InChI | InChI=1S/C30H50O3/c1-17(2)18-11-13-28(6)23(33)16-29(7)19(24(18)28)9-10-21-27(5)14-12-22(32)26(3,4)25(27)20(31)15-30(21,29)8/h18-25,31-33H,1,9-16H2,2-8H3/t18-,19+,20+,21+,22-,23-,24+,25-,27+,28+,29+,30+/m0/s1 |
| InChIKey | IFIRKWSYYGKSNK-VXFPLEGMSA-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 | 5sYFuCEmcpi |
|---|---|
| Name | 3-BETA,6-BETA,16-BETA-TRIHYDROXYLUP-20(29)-ENE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O3 |
| InChI | InChI=1S/C30H50O3/c1-17(2)18-11-13-28(6)23(33)16-29(7)19(24(18)28)9-10-21-27(5)14-12-22(32)26(3,4)25(27)20(31)15-30(21,29)8/h18-25,31-33H,1,9-16H2,2-8H3/t18-,19+,20+,21+,22-,23-,24+,25-,27+,28+,29+,30+/m0/s1 |
| InChIKey | IFIRKWSYYGKSNK-VXFPLEGMSA-N |
| Literature Reference Author | V.A.FACUNDO,C.H.S.ANDRADE,E.R.SILVEIRA,R.BRAZ-FILHO,C.D.HUFF ORD |
| Literature Reference Citation | PHYTOCHEM.,32,411(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95005-2 |
| Molecular Weight | 458.725 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4517 |