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ALVARADOIN_J;(10-S)-C-(1-O-ACETYL-3-O-SENECIOYL)-BETA-D-LYXOPYRANOSYL-1,8,10-TRIHYDROXY-3-METHYLANTHRACEN-9-ONE
SpectraBase Compound ID 6X7fLTQfS9Z
InChI InChI=1S/C27H28O11/c1-11(2)8-18(31)37-24-22(33)25(38-26(23(24)34)36-13(4)28)27(35)14-6-5-7-16(29)19(14)21(32)20-15(27)9-12(3)10-17(20)30/h5-10,22-26,29-30,33-35H,1-4H3/t22-,23-,24-,25-,26-,27-/m0/s1
InChIKey CWTBVTWONZDFAF-QCOJBMJGSA-N
Mol Weight 528.51 g/mol
Molecular Formula C27H28O11
Exact Mass 528.163162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F3OBBAJzolF
Name ALVARADOIN_J;(10-S)-C-(1-O-ACETYL-3-O-SENECIOYL)-BETA-D-LYXOPYRANOSYL-1,8,10-TRIHYDROXY-3-METHYLANTHRACEN-9-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28O11
InChI InChI=1S/C27H28O11/c1-11(2)8-18(31)37-24-22(33)25(38-26(23(24)34)36-13(4)28)27(35)14-6-5-7-16(29)19(14)21(32)20-15(27)9-12(3)10-17(20)30/h5-10,22-26,29-30,33-35H,1-4H3/t22-,23-,24-,25-,26-,27-/m0/s1
InChIKey CWTBVTWONZDFAF-QCOJBMJGSA-N
Literature Reference Author S.S.PHIFER,D.LEE,E.K.SEO,N.C.KIM,T.N.GRAF,D.J.KROLL,H.A.NAVA RRO,R.A.IZYDORE,F.JI
Literature Reference Citation J.NAT.PROD.,70,954(2007)
Literature Reference DOI 10.1021/np070005a
Molecular Weight 528.513 g/mol
Sample ID 30477
Solvent ACETONE-D6