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4'-O-TRANS-PARA-COUMAROYL-LOGANIC_ACID
SpectraBase Compound ID LbvNwqS86By
InChI InChI=1S/C25H30O12/c1-11-16(28)8-14-15(23(32)33)10-34-24(19(11)14)37-25-21(31)20(30)22(17(9-26)35-25)36-18(29)7-4-12-2-5-13(27)6-3-12/h2-7,10-11,14,16-17,19-22,24-28,30-31H,8-9H2,1H3,(H,32,33)/b7-4+/t11-,14+,16-,17-,19+,20-,21-,22-,24-,25+/m0/s1
InChIKey VXKQRJRULSURMZ-LYWFDIHSSA-N
Mol Weight 522.5 g/mol
Molecular Formula C25H30O12
Exact Mass 522.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mmJkkI40RA
Name 4'-O-TRANS-PARA-COUMAROYL-LOGANIC_ACID
Compound Number 177
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O12
InChI InChI=1S/C25H30O12/c1-11-16(28)8-14-15(23(32)33)10-34-24(19(11)14)37-25-21(31)20(30)22(17(9-26)35-25)36-18(29)7-4-12-2-5-13(27)6-3-12/h2-7,10-11,14,16-17,19-22,24-28,30-31H,8-9H2,1H3,(H,32,33)/b7-4+/t11-,14+,16-,17-,19+,20-,21-,22-,24-,25+/m0/s1
InChIKey VXKQRJRULSURMZ-LYWFDIHSSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,53,1055(1990)
Literature Reference DOI 10.1021/np50071a001
Molecular Weight 522.506 g/mol
Solvent CD3OD
Source File Reference UWMZ16159