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ALVARADOIN_N;(10-S)-C-(1-O-ACETYL)-BETA-D-LYXOPYRANOSYL-1,8,10-TRIHYDROXY-3-METHYLANTHRACEN-9-ONE
SpectraBase Compound ID LaL5lEFFiHZ
InChI InChI=1S/C22H22O10/c1-8-6-11-15(13(25)7-8)16(26)14-10(4-3-5-12(14)24)22(11,30)20-18(28)17(27)19(29)21(32-20)31-9(2)23/h3-7,17-21,24-25,27-30H,1-2H3/t17-,18-,19-,20-,21-,22-/m1/s1
InChIKey OQNNWFYYFFGLHR-CGXUPHRESA-N
Mol Weight 446.41 g/mol
Molecular Formula C22H22O10
Exact Mass 446.121297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HSt9CpSrNt1
Name ALVARADOIN_N;(10-S)-C-(1-O-ACETYL)-BETA-D-LYXOPYRANOSYL-1,8,10-TRIHYDROXY-3-METHYLANTHRACEN-9-ONE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O10
InChI InChI=1S/C22H22O10/c1-8-6-11-15(13(25)7-8)16(26)14-10(4-3-5-12(14)24)22(11,30)20-18(28)17(27)19(29)21(32-20)31-9(2)23/h3-7,17-21,24-25,27-30H,1-2H3/t17-,18-,19-,20-,21-,22-/m1/s1
InChIKey OQNNWFYYFFGLHR-CGXUPHRESA-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 446.411 g/mol
Sample ID 30479
Solvent ACETONE-D6