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PYCNALIN;6-O-GALLOYL-1,5-ANHYDRO-MANNITOL
SpectraBase Compound ID I6VVawU25l1
InChI InChI=1S/C13H16O9/c14-6-1-5(2-7(15)10(6)17)13(20)22-4-9-12(19)11(18)8(16)3-21-9/h1-2,8-9,11-12,14-19H,3-4H2/t8-,9-,11-,12-/m1/s1
InChIKey NUVIRDWXIBOJTE-CNVPUSNMSA-N
Mol Weight 316.26 g/mol
Molecular Formula C13H16O9
Exact Mass 316.079432 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Om5Uq3w1OW
Name PYCNALIN;6-O-GALLOYL-1,5-ANHYDRO-MANNITOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O9
InChI InChI=1S/C13H16O9/c14-6-1-5(2-7(15)10(6)17)13(20)22-4-9-12(19)11(18)8(16)3-21-9/h1-2,8-9,11-12,14-19H,3-4H2/t8-,9-,11-,12-/m1/s1
InChIKey NUVIRDWXIBOJTE-CNVPUSNMSA-N
Literature Reference Author A.OGAWA,Y.MIYAMAE,A.HONMA,T.KOYAMA,K.YAZAWA,H.SHIGEMORI
Literature Reference Citation CHEM.PHARM.BULL.,59,672(2011)
Literature Reference DOI 10.1248/cpb.59.672
Molecular Weight 316.265 g/mol
Source File Reference UWIR3163