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METHYL-2-ALPHA,3-BETA-DIHYDROXY-4(18)-NEO-CLERODEN-15-OATE
SpectraBase Compound ID 3fbvA76zU0N
InChI InChI=1S/C21H36O4/c1-13(11-18(23)25-6)7-9-20(4)14(2)8-10-21(5)15(3)19(24)16(22)12-17(20)21/h13-14,16-17,19,22,24H,3,7-12H2,1-2,4-6H3/t13?,14-,16-,17-,19-,20+,21+/m1/s1
InChIKey QFSPHXMKLQWTLA-JBDNHMGWSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8wTD8NVyKSV
Name METHYL-2-ALPHA,3-BETA-DIHYDROXY-4(18)-NEO-CLERODEN-15-OATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36O4
InChI InChI=1S/C21H36O4/c1-13(11-18(23)25-6)7-9-20(4)14(2)8-10-21(5)15(3)19(24)16(22)12-17(20)21/h13-14,16-17,19,22,24H,3,7-12H2,1-2,4-6H3/t13?,14-,16-,17-,19-,20+,21+/m1/s1
InChIKey QFSPHXMKLQWTLA-JBDNHMGWSA-N
Literature Reference Author J.G.URONES,I.S.MARCOS,P.BASABE,A.JIMENEZ,A.GOMEZ,A.M.LITHGOW
Literature Reference Citation PHYTOCHEM.,38,443(1995)
Literature Reference DOI 10.1016/0031-9422(94)00709-3
Molecular Weight 352.514 g/mol
Solvent CDCl3
Source File Reference UWMS4763