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PHAEOCAULISIN_I;5-BETA,10-BETA-DIHYDROXY-1-ALPHA,4-BETA-H-GUAI-7-(11),8-DIEN-12,8-OLIDE
SpectraBase Compound ID CugUtFqJH4W
InChI InChI=1S/C15H20O4/c1-8-4-5-12-14(3,17)7-11-10(6-15(8,12)18)9(2)13(16)19-11/h7-8,12,17-18H,4-6H2,1-3H3/t8-,12+,14+,15+/m1/s1
InChIKey GWHGITGZQCFTQM-QATIJOQPSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DM7nv0b5BRK
Name PHAEOCAULISIN_I;5-BETA,10-BETA-DIHYDROXY-1-ALPHA,4-BETA-H-GUAI-7-(11),8-DIEN-12,8-OLIDE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-8-4-5-12-14(3,17)7-11-10(6-15(8,12)18)9(2)13(16)19-11/h7-8,12,17-18H,4-6H2,1-3H3/t8-,12+,14+,15+/m1/s1
InChIKey GWHGITGZQCFTQM-QATIJOQPSA-N
Literature Reference Author Y.LIU,J.H.MA,Q.ZHAO,C.R.LIAO,L.Q.DING,L.X.CHEN,F.ZHAO,F.QIU
Literature Reference Citation J.NAT.PROD.,76,1150(2013)
Literature Reference DOI 10.1021/np400202f
Molecular Weight 264.321 g/mol
Sample ID 42654
Solvent C5D5N