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CALCARATARIN-B;(Z)-LABDA-8(17),12-DIEN-15-OIC-ACID
SpectraBase Compound ID 5elSFiexfQh
InChI InChI=1S/C20H32O2/c1-14(13-18(21)22)7-9-16-15(2)8-10-17-19(3,4)11-6-12-20(16,17)5/h7,16-17H,2,6,8-13H2,1,3-5H3,(H,21,22)/b14-7-/t16-,17-,20+/m0/s1
InChIKey JSNVJPLVHIOLEM-YPCBCADOSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5FstVfL9feV
Name CALCARATARIN-B;(Z)-LABDA-8(17),12-DIEN-15-OIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-14(13-18(21)22)7-9-16-15(2)8-10-17-19(3,4)11-6-12-20(16,17)5/h7,16-17H,2,6,8-13H2,1,3-5H3,(H,21,22)/b14-7-/t16-,17-,20+/m0/s1
InChIKey JSNVJPLVHIOLEM-YPCBCADOSA-N
Literature Reference Author L.Y.KONG,M.J.QIN,M.NIWA
Literature Reference Citation J.NAT.PROD.,63,939(2000)
Literature Reference DOI 10.1021/np9904962
Molecular Weight 304.473 g/mol
Solvent CDCl3