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9-O-METHYLSTECEPHARINE

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9-O-METHYLSTECEPHARINE
SpectraBase Compound ID EVwVh7fG8lS
InChI InChI=1S/C22H27NO5.ClHO4/c1-23-9-8-14-11-18(26-3)22(28-5)20(24)19(14)16(23)10-13-6-7-17(25-2)21(27-4)15(13)12-23;2-1(3,4)5/h6-7,11,16H,8-10,12H2,1-5H3;(H,2,3,4,5)/t16-,23-;/m0./s1
InChIKey WIVSHXSJBQYHTC-KYRGBVPUSA-N
Mol Weight 485.92 g/mol
Molecular Formula C22H28ClNO9
Exact Mass 485.145259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID z1qVOuasLT
Name 9-O-METHYLSTECEPHARINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28ClNO9
InChI InChI=1S/C22H27NO5.ClHO4/c1-23-9-8-14-11-18(26-3)22(28-5)20(24)19(14)16(23)10-13-6-7-17(25-2)21(27-4)15(13)12-23;2-1(3,4)5/h6-7,11,16H,8-10,12H2,1-5H3;(H,2,3,4,5)/t16-,23-;/m0./s1
InChIKey WIVSHXSJBQYHTC-KYRGBVPUSA-N
Literature Reference Author T.TANAHASHI,Y.SU,N.NAGAKURA,H.NAYESHIRO
Literature Reference Citation CHEM.PHARM.BULL.,48,370(2000)
Literature Reference DOI 10.1248/cpb.48.370
Molecular Weight 485.919 g/mol
Solvent CD3OD
Source File Reference UWLU4974