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PENTA-O-ACETYLPLUMERIDE-GLUCOPYRANOSIDE-ACID
SpectraBase Compound ID FvnGDP3jpix
InChI InChI=1S/C30H34O17/c1-12(41-14(3)32)19-9-30(47-27(19)38)8-7-18-20(26(36)37)10-40-28(22(18)30)46-29-25(44-17(6)35)24(43-16(5)34)23(42-15(4)33)21(45-29)11-39-13(2)31/h7-10,12,18,21-25,28-29H,11H2,1-6H3,(H,36,37)/t12-,18-,21+,22-,23+,24-,25+,28+,29-,30-/m1/s1
InChIKey OFPLVUYWPMZMIK-ITTZOMKESA-N
Mol Weight 666.6 g/mol
Molecular Formula C30H34O17
Exact Mass 666.1796 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3hxDPV93JsF
Name PENTA-O-ACETYLPLUMERIDE-GLUCOPYRANOSIDE-ACID
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34O17
InChI InChI=1S/C30H34O17/c1-12(41-14(3)32)19-9-30(47-27(19)38)8-7-18-20(26(36)37)10-40-28(22(18)30)46-29-25(44-17(6)35)24(43-16(5)34)23(42-15(4)33)21(45-29)11-39-13(2)31/h7-10,12,18,21-25,28-29H,11H2,1-6H3,(H,36,37)/t12-,18-,21+,22-,23+,24-,25+,28+,29-,30-/m1/s1
InChIKey OFPLVUYWPMZMIK-ITTZOMKESA-N
Literature Reference Author A.D.S.BARRETO,M.G.D.CARVALHO,I.D.A.NERY,L.GONZAGA,M.A.C.KAPL AN
Literature Reference Citation J.BRAZ.CHEM.SOC.,9,430(1998)
Literature Reference DOI 10.1590/s0103-50531998000500004
Molecular Weight 666.590 g/mol
Solvent CD3OD
Source File Reference UWMS5516