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GRANDILOBATIN_E;(12-S*,1-E,3-E,8-Z)-15-HYDROXYCEMBRA-1,3,8-TRIEN-10-ONE
SpectraBase Compound ID J0B03S5adRQ
InChI InChI=1S/C20H32O2/c1-15-7-6-8-16(2)13-19(21)14-17(3)10-12-18(11-9-15)20(4,5)22/h9,11,13,17,22H,6-8,10,12,14H2,1-5H3/b15-9+,16-13-,18-11+/t17-/m0/s1
InChIKey GHADJBJUJGZEFC-SFUXFWDLSA-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 1thVGIC89hm
Name GRANDILOBATIN_E;(12-S*,1-E,3-E,8-Z)-15-HYDROXYCEMBRA-1,3,8-TRIEN-10-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-15-7-6-8-16(2)13-19(21)14-17(3)10-12-18(11-9-15)20(4,5)22/h9,11,13,17,22H,6-8,10,12,14H2,1-5H3/b15-9+,16-13-,18-11+/t17-/m0/s1
InChIKey GHADJBJUJGZEFC-SFUXFWDLSA-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 304.473 g/mol
Sample ID 28372
Solvent CDCl3