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(4aR,5S,6R,8S,8aR)-8-hydroxy-5-[2-(5-keto-2H-furan-3-yl)ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid methyl ester

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(4aR,5S,6R,8S,8aR)-8-hydroxy-5-[2-(5-keto-2H-furan-3-yl)ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid methyl ester
SpectraBase Compound ID 1wV9BLedtmz
InChI InChI=1S/C21H30O5/c1-13-10-17(22)21(3)15(19(24)25-4)6-5-7-16(21)20(13,2)9-8-14-11-18(23)26-12-14/h6,11,13,16-17,22H,5,7-10,12H2,1-4H3/t13-,16-,17+,20+,21+/m1/s1
InChIKey WXKAHDUEQYNCAI-JIVFAJJISA-N
Mol Weight 362.47 g/mol
Molecular Formula C21H30O5
Exact Mass 362.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EgL2aH4Ffmi
Name (4aR,5S,6R,8S,8aR)-8-hydroxy-5-[2-(5-keto-2H-furan-3-yl)ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid methyl ester
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O5
InChI InChI=1S/C21H30O5/c1-13-10-17(22)21(3)15(19(24)25-4)6-5-7-16(21)20(13,2)9-8-14-11-18(23)26-12-14/h6,11,13,16-17,22H,5,7-10,12H2,1-4H3/t13-,16-,17+,20+,21+/m1/s1
InChIKey WXKAHDUEQYNCAI-JIVFAJJISA-N
Literature Reference Author B.DAS,M.R.REDDY,R.RAMU,N.RAVINDRANATH,H.HARISH,K.V.S.RAMAKRI SHNA,Y.K.RAO,K.HARAK
Literature Reference Citation PHYTOCHEM.,66,633(2005)
Literature Reference DOI 10.1016/j.phytochem.2005.02.004
Molecular Weight 362.466 g/mol
Solvent Unknown
Source File Reference UWSI25390