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2'-O-(5-PHENYL-2E,4E-PENTADIENOYL)-MUSSAENOSIDIC-ACID
SpectraBase Compound ID EAh3WmpCmxp
InChI InChI=1S/C27H32O11/c1-27(34)12-11-16-17(24(32)33)14-35-25(20(16)27)38-26-23(22(31)21(30)18(13-28)36-26)37-19(29)10-6-5-9-15-7-3-2-4-8-15/h2-10,14,16,18,20-23,25-26,28,30-31,34H,11-13H2,1H3,(H,32,33)/b9-5+,10-6+/t16-,18+,20-,21+,22-,23+,25+,26-,27+/m1/s1
InChIKey PQFVDHZYKOWDQI-ZRARVQOFSA-N
Mol Weight 532.5 g/mol
Molecular Formula C27H32O11
Exact Mass 532.194462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1XUeAK4m8fP
Name 2'-O-[(2E,4E)-5-PHENYLPENTA-2,4-DIENOYL]-MUSSAENOSIDIC-ACID
Compound Number 67
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32O11
InChI InChI=1S/C27H32O11/c1-27(34)12-11-16-17(24(32)33)14-35-25(20(16)27)38-26-23(22(31)21(30)18(13-28)36-26)37-19(29)10-6-5-9-15-7-3-2-4-8-15/h2-10,14,16,18,20-23,25-26,28,30-31,34H,11-13H2,1H3,(H,32,33)/b9-5+,10-6+/t16-,18+,20-,21+,22-,23+,25+,26-,27+/m1/s1
InChIKey PQFVDHZYKOWDQI-ZRARVQOFSA-N
Literature Reference Author B.DINDA,D.R.CHOWDHURY,B.C.MOHANTA
Literature Reference Citation CHEM.PHARM.BULL.,57,765(2009)
Literature Reference DOI 10.1248/cpb.57.765
Molecular Weight 532.544 g/mol
Sample ID 2666
Solvent CD3OD