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NIGRASIN_J;2-[(2-S)-2,3-DIHYDRO-7-HYDROXY-2-(1-HYDROXY-1,5-DIMETHYL-4-HEXEN-1-YL)-4-BENZOFURANYL]-3-METHOXY-5,7-DIHYDROXY-4-H-1-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

NIGRASIN_J;2-[(2-S)-2,3-DIHYDRO-7-HYDROXY-2-(1-HYDROXY-1,5-DIMETHYL-4-HEXEN-1-YL)-4-BENZOFURANYL]-3-METHOXY-5,7-DIHYDROXY-4-H-1-
SpectraBase Compound ID Fd0KfnCHKtP
InChI InChI=1S/C26H28O8/c1-13(2)6-5-9-26(3,31)20-12-16-15(7-8-17(28)23(16)34-20)24-25(32-4)22(30)21-18(29)10-14(27)11-19(21)33-24/h6-8,10-11,20,27-29,31H,5,9,12H2,1-4H3/t20-,26?/m0/s1
InChIKey ZFZCFFNYBORJLD-DQUNLGLBSA-N
Mol Weight 468.5 g/mol
Molecular Formula C26H28O8
Exact Mass 468.178418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4S6S8IeRRQj
Name NIGRASIN_J;2-[(2-S)-2,3-DIHYDRO-7-HYDROXY-2-(1-HYDROXY-1,5-DIMETHYL-4-HEXEN-1-YL)-4-BENZOFURANYL]-3-METHOXY-5,7-DIHYDROXY-4-H-1-
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28O8
InChI InChI=1S/C26H28O8/c1-13(2)6-5-9-26(3,31)20-12-16-15(7-8-17(28)23(16)34-20)24-25(32-4)22(30)21-18(29)10-14(27)11-19(21)33-24/h6-8,10-11,20,27-29,31H,5,9,12H2,1-4H3/t20-,26?/m0/s1
InChIKey ZFZCFFNYBORJLD-DQUNLGLBSA-N
Literature Reference Author X.HU,J.W.WU,X.D.ZHANG,Q.S.ZHAO,J.M.HUANG,H.Y.WANG,A.J.HOU
Literature Reference Citation J.NAT.PROD.,74,816(2011)
Literature Reference DOI 10.1021/np100907d
Molecular Weight 468.504 g/mol
Sample ID 37348
Solvent ACETONE-D6