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Andrographolide
SpectraBase Compound ID GK4Lgend9WV
InChI InChI=1S/C20H30O5/c1-12-4-7-16-19(2,9-8-17(23)20(16,3)11-21)14(12)6-5-13-15(22)10-25-18(13)24/h5,14-17,21-23H,1,4,6-11H2,2-3H3/b13-5+/t14-,15-,16+,17-,19+,20+/m1/s1
InChIKey BOJKULTULYSRAS-OTESTREVSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4y3h11C5VMZ
Name ANDROGRAPHOLIDE;3-[2-[DECAHYDRO-6-HYDROXY-5-(HYDROXYMETHYL)-5,8A-DIMETHYL-2-METHYLENE-1-NAPHTHALENYL]-ETHYLIDENE]-DIHYDRO-4-HYDROXY-2(3H)-FURANONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-12-4-7-16-19(2,9-8-17(23)20(16,3)11-21)14(12)6-5-13-15(22)10-25-18(13)24/h5,14-17,21-23H,1,4,6-11H2,2-3H3/b13-5+/t14-,15-,16+,17-,19+,20+/m1/s1
InChIKey BOJKULTULYSRAS-OTESTREVSA-N
Literature Reference Author X.HE,J.LI,H.GAO,F.QIU,K.HU,X.CUI,X.YAO
Literature Reference Citation DRUG.MET.DISP.,31,983(2003)
Literature Reference DOI 10.1124/dmd.31.8.983
Molecular Weight 350.455 g/mol
Source File Reference UWLU74296