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6-ACETOXY-7,8-EPOXY-3,12-DOLABELLADIEN-13-ONE
SpectraBase Compound ID 7T3I5XBBhRJ
InChI InChI=1S/C22H32O4/c1-13(2)19-16-8-10-22(6)20(26-22)18(25-15(4)23)11-14(3)7-9-21(16,5)12-17(19)24/h7,16,18,20H,8-12H2,1-6H3/b14-7-/t16-,18+,20+,21+,22-/m1/s1
InChIKey BBQSAOCTCFTPCK-JZKKIYNJSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JhuEFHDChLK
Name 6-ACETOXY-7,8-EPOXY-3,12-DOLABELLADIEN-13-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-13(2)19-16-8-10-22(6)20(26-22)18(25-15(4)23)11-14(3)7-9-21(16,5)12-17(19)24/h7,16,18,20H,8-12H2,1-6H3/b14-7-/t16-,18+,20+,21+,22-/m1/s1
InChIKey BBQSAOCTCFTPCK-JZKKIYNJSA-N
Literature Reference Author M.GOVINDAN,G.N.GOVINDAN,D.G.I.KINGSTON
Literature Reference Citation J.NAT.PROD.,58,1174(1995)
Literature Reference DOI 10.1021/np50122a004
Molecular Weight 360.494 g/mol
Solvent CDCl3
Source File Reference UWPR232