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BLETILOL-B;4-ACETOXY-11-METHOXY-3-(4'-HYDROXY-3'-METHOXYPHENYL)-3,4,5,6-TETRAHYDRO-2H-PHENANTHRO-[2,1-B]-PYRAN-8-OL
SpectraBase Compound ID JbxAavh0jc7
InChI InChI=1S/C27H26O7/c1-14(28)34-27-20(16-5-9-21(30)22(11-16)31-2)13-33-24-12-23(32-3)25-18-8-6-17(29)10-15(18)4-7-19(25)26(24)27/h5-6,8-12,20,27,29-30H,4,7,13H2,1-3H3/t20-,27+/m0/s1
InChIKey QDTMSPUGALRFKA-CCLHPLFOSA-N
Mol Weight 462.5 g/mol
Molecular Formula C27H26O7
Exact Mass 462.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DkTmrRA7Jhj
Name BLETILOL-B;4-ACETOXY-11-METHOXY-3-(4'-HYDROXY-3'-METHOXYPHENYL)-3,4,5,6-TETRAHYDRO-2H-PHENANTHRO-[2,1-B]-PYRAN-8-OL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26O7
InChI InChI=1S/C27H26O7/c1-14(28)34-27-20(16-5-9-21(30)22(11-16)31-2)13-33-24-12-23(32-3)25-18-8-6-17(29)10-15(18)4-7-19(25)26(24)27/h5-6,8-12,20,27,29-30H,4,7,13H2,1-3H3/t20-,27+/m0/s1
InChIKey QDTMSPUGALRFKA-CCLHPLFOSA-N
Literature Reference Author M.YAMAKI,L.BAI,T.KATO,K.INOUE,S.TAKAGI
Literature Reference Citation PHYTOCHEM.,32,427(1993)
Literature Reference DOI 10.1016/S0031-9422(00)95008-8
Molecular Weight 462.499 g/mol
Solvent Unknown
Source File Reference UWMS4540