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(3-HYDROXY-OLEAN-12-EN-28-YL)-[4-(4'-NITRO)-CINNAMAMIDO-PIPERAZIN-1-YL]-METHANONE
SpectraBase Compound ID FgUtaARlvWC
InChI InChI=1S/C43H61N3O5/c1-38(2)20-22-43(37(49)45-26-24-44(25-27-45)36(48)15-10-29-8-11-30(12-9-29)46(50)51)23-21-41(6)31(32(43)28-38)13-14-34-40(5)18-17-35(47)39(3,4)33(40)16-19-42(34,41)7/h8-13,15,32-35,47H,14,16-28H2,1-7H3/b15-10+/t32-,33-,34+,35-,40-,41+,42+,43-/m0/s1
InChIKey QICIXFJHZOTKQP-RFCSCMPBSA-N
Mol Weight 700.0 g/mol
Molecular Formula C43H61N3O5
Exact Mass 699.461122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GYMXBzrNz5S
Name (3-HYDROXY-OLEAN-12-EN-28-YL)-[4-(4'-NITRO)-CINNAMAMIDO-PIPERAZIN-1-YL]-METHANONE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H61N3O5
InChI InChI=1S/C43H61N3O5/c1-38(2)20-22-43(37(49)45-26-24-44(25-27-45)36(48)15-10-29-8-11-30(12-9-29)46(50)51)23-21-41(6)31(32(43)28-38)13-14-34-40(5)18-17-35(47)39(3,4)33(40)16-19-42(34,41)7/h8-13,15,32-35,47H,14,16-28H2,1-7H3/b15-10+/t32-,33-,34+,35-,40-,41+,42+,43-/m0/s1
InChIKey QICIXFJHZOTKQP-RFCSCMPBSA-N
Literature Reference Author W.NIE,J.G.LUO,X.B.WANG,H.YIN,H.B.SUN,H.Q.YAO,L.Y.KONG
Literature Reference Citation CHEM.PHARM.BULL.,59,1051(2011)
Literature Reference DOI 10.1248/cpb.59.1051
Molecular Weight 699.974 g/mol
Source File Reference UWIR3508