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(1S,4S,5R,6S,7S,10S)-5,10,11-CADINANETRIOL

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(1S,4S,5R,6S,7S,10S)-5,10,11-CADINANETRIOL
SpectraBase Compound ID EW72C4dLMiB
InChI InChI=1S/C15H28O3/c1-9-5-6-11-12(13(9)16)10(14(2,3)17)7-8-15(11,4)18/h9-13,16-18H,5-8H2,1-4H3/t9-,10?,11-,12?,13?,15-/m0/s1
InChIKey GCABARKLIDPDND-WHHBMTODSA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6k0rG2OReCH
Name (1S,4S,5R,6S,7S,10S)-5,10,11-CADINANETRIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-9-5-6-11-12(13(9)16)10(14(2,3)17)7-8-15(11,4)18/h9-13,16-18H,5-8H2,1-4H3/t9-,10?,11-,12?,13?,15-/m0/s1
InChIKey GCABARKLIDPDND-WHHBMTODSA-N
Literature Reference Author G.APPENDINO,G.CRAVOTTO,O.STERNER,M.BALLERO
Literature Reference Citation J.NAT.PROD.,64,393(2001)
Literature Reference DOI 10.1021/np000468f
Molecular Weight 256.386 g/mol
Solvent CDCl3
Source File Reference UWRU3743