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AGLYCONE_OF_VERRUCOSIDE
SpectraBase Compound ID 2MTr1gkksh3
InChI InChI=1S/C21H34O2/c1-4-13-5-7-15-14-6-8-17-19(23)18(22)10-12-21(17,3)16(14)9-11-20(13,15)2/h4,13-19,22-23H,1,5-12H2,2-3H3/t13-,14-,15-,16-,17+,18-,19+,20+,21+/m0/s1
InChIKey TVNNNAPGBWIBNM-APSZQUKUSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lpg1BuHY4p8
Name AGLYCONE_OF_VERRUCOSIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-4-13-5-7-15-14-6-8-17-19(23)18(22)10-12-21(17,3)16(14)9-11-20(13,15)2/h4,13-19,22-23H,1,5-12H2,2-3H3/t13-,14-,15-,16-,17+,18-,19+,20+,21+/m0/s1
InChIKey TVNNNAPGBWIBNM-APSZQUKUSA-N
Literature Reference Author Y.KASHMAN,D.GREEN,C.GARCIA,D.G.AREVALOS
Literature Reference Citation J.NAT.PROD.,54,1651(1991)
Literature Reference DOI 10.1021/np50078a026
Molecular Weight 318.500 g/mol
Solvent PYRIDINE-D5
Source File Reference UWED18026