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[7R-(7a,9a)]-9-chloro-11-hydroxy-7-[(1'R,3'R)-3'-hydroxy-1'-methylbutoxy]-6-methoxy-7,8,9,10-tetrahydronaphthacene-5,12-dione

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[7R-(7a,9a)]-9-chloro-11-hydroxy-7-[(1'R,3'R)-3'-hydroxy-1'-methylbutoxy]-6-methoxy-7,8,9,10-tetrahydronaphthacene-5,12-dione
SpectraBase Compound ID 89wP4lDx6ss
InChI InChI=1S/C24H25ClO6/c1-11(26)8-12(2)31-17-10-13(25)9-16-18(17)24(30-3)20-19(23(16)29)21(27)14-6-4-5-7-15(14)22(20)28/h4-7,11-13,17,26,29H,8-10H2,1-3H3/t11-,12-,13+,17+/m0/s1
InChIKey XYXXOGPZNGTLBE-APNQJHFZSA-N
Mol Weight 444.91 g/mol
Molecular Formula C24H25ClO6
Exact Mass 444.133966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CILR899uYGQ
Name [7R-(7-ALPHA,9-ALPHA)]-9-CHLORO-11-HYDROXY-7-[(1'R,3'R)-3'-HYDROXY-1'-METHYLBUTOXY]-6-METHOXY-7,8,9,10-TETRAHYDRONAPHTHACENE-5,12-DIONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H25ClO6
InChI InChI=1S/C24H25ClO6/c1-11(26)8-12(2)31-17-10-13(25)9-16-18(17)24(30-3)20-19(23(16)29)21(27)14-6-4-5-7-15(14)22(20)28/h4-7,11-13,17,26,29H,8-10H2,1-3H3/t11-,12-,13+,17+/m0/s1
InChIKey XYXXOGPZNGTLBE-APNQJHFZSA-N
Literature Reference Author R.C.CAMBIE,K.C.HIGGS,P.S.RUTLEDGE,P.D.WOODGATE
Literature Reference Citation AUSTR.J.CHEM.,47,1295(1994)
Literature Reference DOI 10.1071/ch9941295
Molecular Weight 444.912 g/mol
Solvent Unknown
Source File Reference UWVP6366