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(-)-O-3-PHOSPHO-(3R,4S,5R)-TRIHYDROXY-1-CYCLOPENTENYL-ACETATE-TRISODIUM-SALT

View entire compound with spectra: 2 NMR

(-)-O-3-PHOSPHO-(3R,4S,5R)-TRIHYDROXY-1-CYCLOPENTENYL-ACETATE-TRISODIUM-SALT
SpectraBase Compound ID 7E8YZKZNXsD
InChI InChI=1S/C7H11O8P.3Na/c8-5(9)2-3-1-4(7(11)6(3)10)15-16(12,13)14;;;/h1,4,6-7,10-11H,2H2,(H,8,9)(H2,12,13,14);;;/q;3*+1/p-3/t4-,6-,7-;;;/m1.../s1
InChIKey RXHUITWXMMBXKM-RBECAVKOSA-K
Mol Weight 320.07606984 g/mol
Molecular Formula C7H8Na3O8P
Exact Mass 319.964987 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HW0u3ZLyhzW
Name (-)-O-3-PHOSPHO-(3R,4S,5R)-TRIHYDROXY-1-CYCLOPENTENYL-ACETATE-TRISODIUM-SALT
Compound Number 3-P
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H8Na3O8P
InChI InChI=1S/C7H11O8P.3Na/c8-5(9)2-3-1-4(7(11)6(3)10)15-16(12,13)14;;;/h1,4,6-7,10-11H,2H2,(H,8,9)(H2,12,13,14);;;/q;3*+1/p-3/t4-,6-,7-;;;/m1.../s1
InChIKey RXHUITWXMMBXKM-RBECAVKOSA-K
Literature Reference Author M.AN,T.TOOCHINDA,P.A.BARLETT
Literature Reference Citation J.ORG.CHEM.,66,1326(2001)
Literature Reference DOI 10.1021/jo001121k
Solvent D2O
Source File Reference UWMS25827