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TEPHROCANDIDIN_A;2,3-DIHYDRO-7-HYDROXY-8-[(Z)-3-HYDROXY-3-METHYLBUT-1-ENYL]-5-METHOXY-2-PHENYLCHROMAN-4-ONE
SpectraBase Compound ID JzxhESnnzhR
InChI InChI=1S/C21H22O5/c1-21(2,24)10-9-14-15(22)11-18(25-3)19-16(23)12-17(26-20(14)19)13-7-5-4-6-8-13/h4-11,17,22,24H,12H2,1-3H3/b10-9-
InChIKey YSYPNKZOQYHUSV-KTKRTIGZSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AWh4LbT5oc9
Name TEPHROCANDIDIN_A;2,3-DIHYDRO-7-HYDROXY-8-[(Z)-3-HYDROXY-3-METHYLBUT-1-ENYL]-5-METHOXY-2-PHENYLCHROMAN-4-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O5
InChI InChI=1S/C21H22O5/c1-21(2,24)10-9-14-15(22)11-18(25-3)19-16(23)12-17(26-20(14)19)13-7-5-4-6-8-13/h4-11,17,22,24H,12H2,1-3H3/b10-9-
InChIKey YSYPNKZOQYHUSV-KTKRTIGZSA-N
Literature Reference Author M.E.F.HEGAZY,A.E.H.H.MOHAMED,A.M.EL-HALAWANY,P.C.DJEMGOU,A.A .SHAHAT,P.W.PARE
Literature Reference Citation J.NAT.PROD.,74,937(2011)
Literature Reference DOI 10.1021/np100378d
Molecular Weight 354.403 g/mol
Sample ID 38037
Solvent CDCl3