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ENT-(15E)-CAFFEOYLOXY-8(17)-LABDEN-18-OIC-ACID
SpectraBase Compound ID 3wQC2EKBtlz
InChI InChI=1S/C29H40O6/c1-19(14-17-35-26(32)13-9-21-8-11-23(30)24(31)18-21)6-10-22-20(2)7-12-25-28(22,3)15-5-16-29(25,4)27(33)34/h8-9,11,13,18-19,22,25,30-31H,2,5-7,10,12,14-17H2,1,3-4H3,(H,33,34)/b13-9+/t19-,22+,25-,28-,29+/m0/s1
InChIKey SLUZPAKLAPWHGG-GIXWPSBNSA-N
Mol Weight 484.6 g/mol
Molecular Formula C29H40O6
Exact Mass 484.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zEMk5iWydf
Name ENT-(15E)-CAFFEOYLOXY-8(17)-LABDEN-18-OIC-ACID
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H40O6
InChI InChI=1S/C29H40O6/c1-19(14-17-35-26(32)13-9-21-8-11-23(30)24(31)18-21)6-10-22-20(2)7-12-25-28(22,3)15-5-16-29(25,4)27(33)34/h8-9,11,13,18-19,22,25,30-31H,2,5-7,10,12,14-17H2,1,3-4H3,(H,33,34)/b13-9+/t19-,22+,25-,28-,29+/m0/s1
InChIKey SLUZPAKLAPWHGG-GIXWPSBNSA-N
Literature Reference Author L.MAMBU,P.GRELLIER,L.FLORENT,R.JOYEAU,D.RAMANITRAHASIMBOLA,P .RASOANAIVO,F.FRAPPI
Literature Reference Citation PHYTOCHEM.,67,444(2006)
Literature Reference DOI 10.1016/j.phytochem.2005.11.024
Molecular Weight 484.633 g/mol
Sample ID 66057
Solvent CD3OD