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13-ETHOXY-LABDA-8(17),11,14-TRIEN-19-OIC-ACID-METHYLFTALIMIDE-ESTER
SpectraBase Compound ID DuOMemISjcI
InChI InChI=1S/2C31H39NO5/c2*1-7-29(4,37-8-2)19-16-24-21(3)14-15-25-30(24,5)17-11-18-31(25,6)28(35)36-20-32-26(33)22-12-9-10-13-23(22)27(32)34/h2*7,9-10,12-13,16,19,24-25H,1,3,8,11,14-15,17-18,20H2,2,4-6H3/b2*19-16+/t24-,25+,29+,30+,31-;24-,25+,29-,30+,31-/m00/s1
InChIKey YVWZVMCODOQDSK-LFNXMOCISA-N
Mol Weight 1011.3 g/mol
Molecular Formula C62H78N2O10
Exact Mass 1010.565647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KtCum7hhcY
Name 13-ETHOXY-LABDA-8(17),11,14-TRIEN-19-OIC-ACID-METHYLFTALIMIDE-ESTER
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H78N2O10
InChI InChI=1S/2C31H39NO5/c2*1-7-29(4,37-8-2)19-16-24-21(3)14-15-25-30(24,5)17-11-18-31(25,6)28(35)36-20-32-26(33)22-12-9-10-13-23(22)27(32)34/h2*7,9-10,12-13,16,19,24-25H,1,3,8,11,14-15,17-18,20H2,2,4-6H3/b2*19-16+/t24-,25+,29+,30+,31-;24-,25+,29-,30+,31-/m00/s1
InChIKey YVWZVMCODOQDSK-LFNXMOCISA-N
Literature Reference Author M.IWAMOTO,H.OHTSU,H.TOKUDA,H.NISHINO,S.MATSUNAGA,R.TANAKA
Literature Reference Citation BIOORG.MED.CHEM.,9,1911(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00099-2
Molecular Weight 1011.309 g/mol
Solvent CDCl3
Source File Reference UWMS22043