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LACTUCAIN-A
SpectraBase Compound ID 1URwcHLOokv
InChI InChI=1S/C30H32O7/c1-11-7-17(31)21-13(3)9-19(25-15(5)29(33)36-27(25)23(11)21)35-20-10-14(4)22-18(32)8-12(2)24(22)28-26(20)16(6)30(34)37-28/h7-8,16,19-20,23-28H,5,9-10H2,1-4,6H3/t16-,19+,20-,23+,24-,25-,26+,27-,28+/m0/s1
InChIKey AULGBYCWKJOWIY-YQBMIPPCSA-N
Mol Weight 504.6 g/mol
Molecular Formula C30H32O7
Exact Mass 504.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FcSEDPCvTpo
Name LACTUCAIN-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32O7
InChI InChI=1S/C30H32O7/c1-11-7-17(31)21-13(3)9-19(25-15(5)29(33)36-27(25)23(11)21)35-20-10-14(4)22-18(32)8-12(2)24(22)28-26(20)16(6)30(34)37-28/h7-8,16,19-20,23-28H,5,9-10H2,1-4,6H3/t16-,19+,20-,23+,24-,25-,26+,27-,28+/m0/s1
InChIKey AULGBYCWKJOWIY-YQBMIPPCSA-N
Literature Reference Author C.C.HOU,S.J.LIN,J.T.CHENG,F.L.HSU
Literature Reference Citation J.NAT.PROD.,66,625(2003)
Literature Reference DOI 10.1021/np0205349
Molecular Weight 504.580 g/mol
Solvent ACETONE-D6:D2O
Source File Reference UWSI7710