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GRANDILOBATIN_B;(3-S*,4-S*,12-S*,1-E,7-E)-3,4-EPOXY-15-HYDROXYCEMBRA-1,7-DIEN-10-ONE
SpectraBase Compound ID ENQ667lH7cB
InChI InChI=1S/C20H32O3/c1-14-7-6-10-20(5)18(23-20)13-16(19(3,4)22)9-8-15(2)12-17(21)11-14/h7,13,15,18,22H,6,8-12H2,1-5H3/b14-7+,16-13+/t15-,18-,20-/m0/s1
InChIKey IRGVGKNVASOSJW-FCECOGMUSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bu1DVt54vtX
Name GRANDILOBATIN_B;(3-S*,4-S*,12-S*,1-E,7-E)-3,4-EPOXY-15-HYDROXYCEMBRA-1,7-DIEN-10-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-14-7-6-10-20(5)18(23-20)13-16(19(3,4)22)9-8-15(2)12-17(21)11-14/h7,13,15,18,22H,6,8-12H2,1-5H3/b14-7+,16-13+/t15-,18-,20-/m0/s1
InChIKey IRGVGKNVASOSJW-FCECOGMUSA-N
Literature Reference Author A.F.AHMED,S.H.TAI,Z.H.WEN,J.H.SU,Y.C.WU,W.P.HU,J.H.SHEU
Literature Reference Citation J.NAT.PROD.,71,946(2008)
Literature Reference DOI 10.1021/np7007335
Molecular Weight 320.472 g/mol
Sample ID 28369
Solvent CDCl3