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OPHIOHAYATONE-B;1-HYDROXY-2-HYDROXYMETHYLANTHRAQUINONE-3-O-BETA-PRIMEVEROSIDE

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OPHIOHAYATONE-B;1-HYDROXY-2-HYDROXYMETHYLANTHRAQUINONE-3-O-BETA-PRIMEVEROSIDE
SpectraBase Compound ID CDXH56apXUm
InChI InChI=1S/C26H28O14/c27-6-12-14(5-11-16(19(12)31)18(30)10-4-2-1-3-9(10)17(11)29)39-26-24(36)22(34)21(33)15(40-26)8-38-25-23(35)20(32)13(28)7-37-25/h1-5,13,15,20-28,31-36H,6-8H2/t13-,15-,20+,21-,22+,23-,24-,25+,26-/m1/s1
InChIKey NVKNRXOMCYTFJF-WFLOGZPDSA-N
Mol Weight 564.5 g/mol
Molecular Formula C26H28O14
Exact Mass 564.147906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LCsx3CwSaxa
Name OPHIOHAYATONE-B;1-HYDROXY-2-HYDROXYMETHYLANTHRAQUINONE-3-O-BETA-PRIMEVEROSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28O14
InChI InChI=1S/C26H28O14/c27-6-12-14(5-11-16(19(12)31)18(30)10-4-2-1-3-9(10)17(11)29)39-26-24(36)22(34)21(33)15(40-26)8-38-25-23(35)20(32)13(28)7-37-25/h1-5,13,15,20-28,31-36H,6-8H2/t13-,15-,20+,21-,22+,23-,24-,25+,26-/m1/s1
InChIKey NVKNRXOMCYTFJF-WFLOGZPDSA-N
Literature Reference Author H.H.CHAN,C.Y.LI,A.G.DAMU,T.S.WU
Literature Reference Citation CHEM.PHARM.BULL.,53,1232(2005)
Literature Reference DOI 10.1248/cpb.53.1232
Molecular Weight 564.500 g/mol
Sample ID 33297
Solvent DMSO-D6