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EXCOECARIN-T1-DIMETHYL-ESTER;ENT-14S,15-EPOXY-2,3-SECO-13-EPI-LABDANE-2,3-DIOIC-ACID-DIMETHYL-ESTER
SpectraBase Compound ID L9c2kG7SHZQ
InChI InChI=1S/C22H36O6/c1-19(2,18(24)26-7)14-8-10-21(4)15(20(14,3)12-17(23)25-6)9-11-22(5,28-21)16-13-27-16/h14-16H,8-13H2,1-7H3/t14-,15+,16+,20-,21+,22+/m1/s1
InChIKey LOMIMFGOZFHXSO-OFUYBIASSA-N
Mol Weight 396.5 g/mol
Molecular Formula C22H36O6
Exact Mass 396.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LcpWY6XgJ4G
Name EXCOECARIN-T1-DIMETHYL-ESTER;ENT-14S,15-EPOXY-2,3-SECO-13-EPI-LABDANE-2,3-DIOIC-ACID-DIMETHYL-ESTER
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O6
InChI InChI=1S/C22H36O6/c1-19(2,18(24)26-7)14-8-10-21(4)15(20(14,3)12-17(23)25-6)9-11-22(5,28-21)16-13-27-16/h14-16H,8-13H2,1-7H3/t14-,15+,16+,20-,21+,22+/m1/s1
InChIKey LOMIMFGOZFHXSO-OFUYBIASSA-N
Literature Reference Author T.KONISHI,K.YAMAZOE,T.KONOSHIMA,Y.FUJIWARA
Literature Reference Citation PHYTOCHEM.,64,835(2003)
Literature Reference DOI 10.1016/j.phytochem.2003.09.001
Molecular Weight 396.524 g/mol
Solvent CDCl3
Source File Reference UWKP5813