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(+)-Praeruptorin A

Compound with spectra: 3 NMR, and 1 FTIR

(+)-Praeruptorin A
SpectraBase Compound ID 6u4b4aEMXnb
InChI InChI=1S/C21H22O7/c1-6-11(2)20(24)27-19-18(25-12(3)22)16-14(28-21(19,4)5)9-7-13-8-10-15(23)26-17(13)16/h6-10,18-19H,1-5H3/b11-6-/t18-,19-/m0/s1
InChIKey XGPBRZDOJDLKOT-NXIDYTHLSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol
Enantiomer InChIKey XGPBRZDOJDLKOT-YRCPKEQFSA-N

View Spectrum of (+)-Praeruptorin A

ATR-IR Spectrum
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 24915

View Spectrum of (+)-Praeruptorin A

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of (+)-Praeruptorin A

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of (+)-Praeruptorin A

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
  • (2Z)-2-methyl-2-butenoic acid, (9S,10S)-10-(acetyloxy)-9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b']dipyran-9-yl ester
  • ISOPTERYKSIN
  • (+)-PRAERUPTORIN;(+)-CIS-4'-ACETYL-3'-ANGELOYL-KHELLACTONE
  • (+)-CIS-4'-ACETYL-3'-ANGELOYL-KHELLACTONE
(+/-)-PRAERUPTORIN-A;PA
(+)-CIS-4'-ACETYL-3'-ANGELOYL-KHELLACTONE
(+)-TRANS-4'-ACETYL-3'-TIGLOYL-KHELLACTONE
QIANHUCOUMARIN-H;3'S-ANGELOYLOXY-4'R-ISOVALERYLOXY-3',4'-DIHYDROSESELIN
(9R,10R)-8,8-dimethyl-9-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromene-10-yl(Z)-2-methylbut-2-enoate
(+)-ANOMALIN
(+)-CIS-(3'S,4'S)-3'-ANGELOYL-4'-TIGLOYLKHELLACTONE
(+)-SAMIDIN
(+/-)-CIS-3',4'-DIACETOXY-3',4'-DIHYDROSESELIN
3'(R)-Isobutyryloxy-4'(R)-acetoxy-3',4'-dihydroseselin
(-)-VISNADIN;3'S-2-METHYLBUTYRYLOXY-4'S-ACETOXY-3',4'-DIHYDROSESELIN
Title Journal or Book Year
Cytotoxic pyranocoumarins from roots of Peucedanum japonicum Phytochemistry 1992
Cytotoxic pyranocoumarins from the aerial parts of Peucedanum japonicum Phytochemistry 1991
(+)-CIS-4'-ACETYL-3'-ANGELOYL-KHELLACTONE
Vendor/Supplier Catalog Number
Cayman Chemical Company
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