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3-BETA,5-BETA,16-ALPHA-TRIHYDROXYHALIMA-13(14)-EN-15,16-OLIDE;4-[2-[(2S,3R,8S,6R)-6,8-DIHYDROXY-2,3,7,7-TETRAMETHYLBICYCLO-[4.4.0]-DEC-2-YL]-ETHYL
SpectraBase Compound ID 1tgm0nllYpx
InChI InChI=1S/C20H32O5/c1-12-7-10-20(24)14(5-6-15(21)18(20,2)3)19(12,4)9-8-13-11-16(22)25-17(13)23/h11-12,14-15,17,21,23-24H,5-10H2,1-4H3/t12-,14-,15+,17-,19+,20-/m1/s1
InChIKey YAGMCYJJNFHJLU-RJPDJWRQSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3tcmB9JhT3
Name 3-BETA,5-BETA,16-ALPHA-TRIHYDROXYHALIMA-13(14)-EN-15,16-OLIDE;4-[2-[(2S,3R,8S,6R)-6,8-DIHYDROXY-2,3,7,7-TETRAMETHYLBICYCLO-[4.4.0]-DEC-2-YL]-ETHYL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-12-7-10-20(24)14(5-6-15(21)18(20,2)3)19(12,4)9-8-13-11-16(22)25-17(13)23/h11-12,14-15,17,21,23-24H,5-10H2,1-4H3/t12-,14-,15+,17-,19+,20-/m1/s1
InChIKey YAGMCYJJNFHJLU-RJPDJWRQSA-N
Literature Reference Author C.Y.CHEN,F.R.CHANG,Y.C.SHIH,T.J.HSIEH,Y.C.CHIA,H.Y.TSENG,H.C .CHEN,S.J.CHEN,M.C.H
Literature Reference Citation J.NAT.PROD.,63,1475(2000)
Literature Reference DOI 10.1021/np000176e
Molecular Weight 352.471 g/mol
Solvent CD3OD