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BELAMCANDONE-P-DIACETATE;9,9B-DI-[(Z)-10-HEPTADECENYL]-4A,8-DIACETATE-2,7-DIMETHOXY-1,4-DIOXO-1,4,4A,9B-TETRAHYDRO-DIBENZOFURAN
SpectraBase Compound ID 3qcfFHxRUgw
InChI InChI=1S/C52H80O9/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-43-48-44(39-45(57-5)49(43)59-41(3)53)61-52(60-42(4)54)47(55)40-46(58-6)50(56)51(48,52)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h17-20,39-40H,7-16,21-38H2,1-6H3/b19-17-,20-18-/t51-,52+/m0/s1
InChIKey QBYOAMWJYGGIRZ-DCWLVMIQSA-N
Mol Weight 849.2 g/mol
Molecular Formula C52H80O9
Exact Mass 848.580234 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3hT4WTI3Vwe
Name BELAMCANDONE-P-DIACETATE;9,9B-DI-[(Z)-10-HEPTADECENYL]-4A,8-DIACETATE-2,7-DIMETHOXY-1,4-DIOXO-1,4,4A,9B-TETRAHYDRO-DIBENZOFURAN
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H80O9
InChI InChI=1S/C52H80O9/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-43-48-44(39-45(57-5)49(43)59-41(3)53)61-52(60-42(4)54)47(55)40-46(58-6)50(56)51(48,52)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h17-20,39-40H,7-16,21-38H2,1-6H3/b19-17-,20-18-/t51-,52+/m0/s1
InChIKey QBYOAMWJYGGIRZ-DCWLVMIQSA-N
Literature Reference Author K.SEKI,K.HAGA,R.KANEKO
Literature Reference Citation PHYTOCHEM.,38,965(1995)
Literature Reference DOI 10.1016/0031-9422(94)00731-8
Molecular Weight 849.202 g/mol
Solvent CDCl3
Source File Reference UWMS3833