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PULICANOL-DIACETATE;(1E)-4-ALPHA,5-BETA-EPOXY-6-ALPHA,8-BETA,14-TRIACETOXY-7-BETA-H-GERMACRA-1(10)-ENE
SpectraBase Compound ID E8bBUnhMVF3
InChI InChI=1S/C21H32O7/c1-12(2)18-17(26-14(4)23)10-16(11-25-13(3)22)8-7-9-21(6)20(28-21)19(18)27-15(5)24/h8,12,17-20H,7,9-11H2,1-6H3/b16-8+/t17-,18+,19+,20-,21-/m0/s1
InChIKey USLIXTLJRXGPBH-ZGAGYSKKSA-N
Mol Weight 396.5 g/mol
Molecular Formula C21H32O7
Exact Mass 396.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IBZMqncsxoQ
Name PULICANOL-DIACETATE;(1E)-4-ALPHA,5-BETA-EPOXY-6-ALPHA,8-BETA,14-TRIACETOXY-7-BETA-H-GERMACRA-1(10)-ENE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O7
InChI InChI=1S/C21H32O7/c1-12(2)18-17(26-14(4)23)10-16(11-25-13(3)22)8-7-9-21(6)20(28-21)19(18)27-15(5)24/h8,12,17-20H,7,9-11H2,1-6H3/b16-8+/t17-,18+,19+,20-,21-/m0/s1
InChIKey USLIXTLJRXGPBH-ZGAGYSKKSA-N
Literature Reference Author J.TRIANA,M.LOPEZ,F.J.PEREZ,J.GONZALEZ-PLATAS,J.QUINTANA,F.ES TEVEZ,F.LEON,J.BERME
Literature Reference Citation J.NAT.PROD.,68,523(2005)
Literature Reference DOI 10.1021/np0496183
Molecular Weight 396.481 g/mol
Solvent CDCl3
Source File Reference UWMZ9754