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(7S,9S,1' RS)-7,9-Dihydroxy-9-(1'-hydroxyethyl)-6,11-dimethoxy-7,8,9,10-tetrahydronaphthacene-5,12-dione
SpectraBase Compound ID 3IS8t2noR7h
InChI InChI=1S/C22H22O7/c1-10(23)22(27)8-13-15(14(24)9-22)21(29-3)17-16(20(13)28-2)18(25)11-6-4-5-7-12(11)19(17)26/h4-7,10,14,23-24,27H,8-9H2,1-3H3/t10-,14+,22+/m1/s1
InChIKey JTQZTTDJKRYUNV-OBJCXTSSSA-N
Mol Weight 398.41 g/mol
Molecular Formula C22H22O7
Exact Mass 398.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CGKKNvEjnrY
Name (7S,9S,1'RS)-7,9-DIHYDROXY-9-(1'-HYDROXYETHYL)-6,11-DIMETHOXY-7,8,9,10-TETRAHYDRONAPHTHACENE-5,12-DIONE
Compound Number 74/78
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O7
InChI InChI=1S/C22H22O7/c1-10(23)22(27)8-13-15(14(24)9-22)21(29-3)17-16(20(13)28-2)18(25)11-6-4-5-7-12(11)19(17)26/h4-7,10,14,23-24,27H,8-9H2,1-3H3/t10-,14+,22+/m1/s1
InChIKey JTQZTTDJKRYUNV-OBJCXTSSSA-N
Literature Reference Author R.C.CAMBIE,R.B.CLARK,J.J.RUSTENHOVEN,P.S.RUTLEDGE
Literature Reference Citation AUSTR.J.CHEM.,52,781(1999)
Literature Reference DOI 10.1071/CH99014
Molecular Weight 398.412 g/mol
Solvent Unknown
Source File Reference UWRU4892