John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=L24qp6lyWmV SpectraBase Spectrum ID=1kAIBpC5kOo

(accessed ).
BRASIMARIN-C
SpectraBase Compound ID L24qp6lyWmV
InChI InChI=1S/C25H24O5/c1-13(2)10-11-17-23(28)20-18(16-8-6-5-7-9-16)12-19(26)30-25(20)21-22(27)14(3)15(4)29-24(17)21/h5-10,12,14-15,28H,11H2,1-4H3/t14?,15-/m1/s1
InChIKey ZJXOEBUGDGYYOO-YSSOQSIOSA-N
Mol Weight 404.46 g/mol
Molecular Formula C25H24O5
Exact Mass 404.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1kAIBpC5kOo
Name BRASIMARIN-C
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24O5
InChI InChI=1S/C25H24O5/c1-13(2)10-11-17-23(28)20-18(16-8-6-5-7-9-16)12-19(26)30-25(20)21-22(27)14(3)15(4)29-24(17)21/h5-10,12,14-15,28H,11H2,1-4H3/t14?,15-/m1/s1
InChIKey ZJXOEBUGDGYYOO-YSSOQSIOSA-N
Literature Reference Author C.ITO,M.ITOIGAWA,Y.MISHINA,V.C.FILHO,F.ENJO,H.TOKUDA,H.NISHI NO,H.FURUKAWA
Literature Reference Citation J.NAT.PROD.,66,368(2003)
Literature Reference DOI 10.1021/np0203640
Molecular Weight 404.463 g/mol
Solvent CDCl3
Source File Reference UWSI4627
SpectraBase Batch ID CDaqwB97cEM