SpectraBase Compound ID | 1HvSD1obhDr |
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InChI | InChI=1S/C30H50O2/c1-25(2)13-14-27(5)15-16-28(6)19(20(27)18-25)9-10-22-29(28,7)12-11-21-26(3,4)23(31)17-24(32)30(21,22)8/h9,20-24,31-32H,10-18H2,1-8H3/t20-,21-,22-,23-,24+,27+,28+,29+,30-/m0/s1 |
InChIKey | VPWXGMNKWRCBHL-JUICUVAGSA-N |
Mol Weight | 442.7 g/mol |
Molecular Formula | C30H50O2 |
Exact Mass | 442.381081 g/mol |
SpectraBase Spectrum ID | Ck43qCpdPUq |
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Name | 1-(EPI)-CASTANOPSOL;OLEAN-12-ENE-1-BETA,3-BETA-DIOL |
Compound Number | 6 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H50O2 |
InChI | InChI=1S/C30H50O2/c1-25(2)13-14-27(5)15-16-28(6)19(20(27)18-25)9-10-22-29(28,7)12-11-21-26(3,4)23(31)17-24(32)30(21,22)8/h9,20-24,31-32H,10-18H2,1-8H3/t20-,21-,22-,23-,24+,27+,28+,29+,30-/m0/s1 |
InChIKey | VPWXGMNKWRCBHL-JUICUVAGSA-N |
Literature Reference Author | M.F.D.ARAUJO,R.BRAZ-FILHO,M.G.D.CARVALHO,I.J.C.VIEIRA |
Literature Reference Citation | QUIM.NOVA,35,2202(2012) |
Literature Reference DOI | 10.1590/s0100-40422012001100019 |
Molecular Weight | 442.726 g/mol |
Solvent | CDCl3 |
Source File Reference | UWIR12581 |