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7-BETA,8-ALPHA,9-ALPHA-TRIHYDROXYLONGIPINAN-1-ONE-7,8-ACETONIDE-9-MESYLATE
SpectraBase Compound ID 7ExrMGkghWV
InChI InChI=1S/C19H30O6S/c1-9-8-10(20)12-13-11(9)19(12,6)16(25-26(7,21)22)14-15(17(13,2)3)24-18(4,5)23-14/h9,11-16H,8H2,1-7H3/t9-,11-,12+,13-,14+,15+,16+,19+/m0/s1
InChIKey IBCKDBIOCPOVRH-BJJPWJBBSA-N
Mol Weight 386.5 g/mol
Molecular Formula C19H30O6S
Exact Mass 386.17631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DosDESgjOPd
Name 7-BETA,8-ALPHA,9-ALPHA-TRIHYDROXYLONGIPINAN-1-ONE-7,8-ACETONIDE-9-MESYLATE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O6S
InChI InChI=1S/C19H30O6S/c1-9-8-10(20)12-13-11(9)19(12,6)16(25-26(7,21)22)14-15(17(13,2)3)24-18(4,5)23-14/h9,11-16H,8H2,1-7H3/t9-,11-,12+,13-,14+,15+,16+,19+/m0/s1
InChIKey IBCKDBIOCPOVRH-BJJPWJBBSA-N
Literature Reference Author L.U.ROMAN,L.G.ZEPEDA,N.R.MORALES,S.FLORES,J.D.HERNANDEZ,C.M. CERDA-GARCIA-ROJAS,P
Literature Reference Citation J.NAT.PROD.,59,391(1996)
Literature Reference DOI 10.1021/np960072x
Molecular Weight 386.504 g/mol
Solvent CDCl3
Source File Reference UWVP2427