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HYDRANGEIC_ACID_4'-O-BETA-D-GLUCOPYRANOSIDE

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HYDRANGEIC_ACID_4'-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID A6pGdzmQ7up
InChI InChI=1S/C21H22O9/c22-10-15-17(24)18(25)19(26)21(30-15)29-13-8-5-11(6-9-13)4-7-12-2-1-3-14(23)16(12)20(27)28/h1-9,15,17-19,21-26H,10H2,(H,27,28)/b7-4+/t15-,17-,18+,19-,21-/m0/s1
InChIKey NHIDPRPJJPJNAB-HYVFPDOPSA-N
Mol Weight 418.4 g/mol
Molecular Formula C21H22O9
Exact Mass 418.126382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2QviLcnOJux
Name HYDRANGEIC_ACID_4'-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O9
InChI InChI=1S/C21H22O9/c22-10-15-17(24)18(25)19(26)21(30-15)29-13-8-5-11(6-9-13)4-7-12-2-1-3-14(23)16(12)20(27)28/h1-9,15,17-19,21-26H,10H2,(H,27,28)/b7-4+/t15-,17-,18+,19-,21-/m0/s1
InChIKey NHIDPRPJJPJNAB-HYVFPDOPSA-N
Literature Reference Author A.BADER,N.D.TOMMASI,R.COTUGNO,A.BRACA
Literature Reference Citation J.NAT.PROD.,74,1421(2011)
Literature Reference DOI 10.1021/np200143s
Molecular Weight 418.400 g/mol
Sample ID 38446
Solvent CD3OD