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NEOVERRUCOSAN-5-BETA,9-BETA,18-BETA-TRIOL

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NEOVERRUCOSAN-5-BETA,9-BETA,18-BETA-TRIOL
SpectraBase Compound ID 9e8I9rIAEXC
InChI InChI=1S/C20H34O3/c1-11(2)12-5-6-19(4)14(22)8-18(3)9-15(23)20(10-21)7-13(20)17(18)16(12)19/h11-17,21-23H,5-10H2,1-4H3/t12-,13-,14-,15+,16+,17+,18-,19+,20+/m0/s1
InChIKey JAYDSYVXWHKZDH-MUOQQGGZSA-N
Mol Weight 322.5 g/mol
Molecular Formula C20H34O3
Exact Mass 322.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6G8KyssPMor
Name NEOVERRUCOSAN-5-BETA,9-BETA,18-BETA-TRIOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-11(2)12-5-6-19(4)14(22)8-18(3)9-15(23)20(10-21)7-13(20)17(18)16(12)19/h11-17,21-23H,5-10H2,1-4H3/t12-,13-,14-,15+,16+,17+,18-,19+,20+/m0/s1
InChIKey JAYDSYVXWHKZDH-MUOQQGGZSA-N
Literature Reference Author A.SPYERE,D.C.ROWLEY,P.R.JENSEN,W.FENICAL
Literature Reference Citation J.NAT.PROD.,66,818(2003)
Literature Reference DOI 10.1021/np0205351
Molecular Weight 322.488 g/mol
Solvent CDCl3
Source File Reference UWSI7888