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CHAGRESNOL;6-BETA,17-DIHYDROXY-18-ACETOXYCASSAN-13,15-DIENE
SpectraBase Compound ID Lqt7COZU8Aj
InChI InChI=1S/C22H34O4/c1-5-15-7-8-18-16(17(15)12-23)11-19(25)20-21(3,13-26-14(2)24)9-6-10-22(18,20)4/h5,16,18-20,23,25H,1,6-13H2,2-4H3/t16-,18-,19+,20-,21-,22+/m0/s1
InChIKey PAKBXHOEKOBBDP-BGOZWBLRSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K5eBDXO7hZT
Name CHAGRESNOL;6-BETA,17-DIHYDROXY-18-ACETOXYCASSAN-13,15-DIENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-5-15-7-8-18-16(17(15)12-23)11-19(25)20-21(3,13-26-14(2)24)9-6-10-22(18,20)4/h5,16,18-20,23,25H,1,6-13H2,2-4H3/t16-,18-,19+,20-,21-,22+/m0/s1
InChIKey PAKBXHOEKOBBDP-BGOZWBLRSA-N
Literature Reference Author D.TORRES-MENDOZA,L.D.U.GONZALEZ,E.ORTEGA-BARRIA,P.D.COLEY,T. A.KURSAR,T.L.CAPSON,
Literature Reference Citation J.NAT.PROD.,67,1711(2004)
Literature Reference DOI 10.1021/np049890c
Molecular Weight 362.510 g/mol
Solvent CDCl3
Source File Reference UWMZ6591