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SECOSUBAMOLIDE-A
SpectraBase Compound ID 4PzFH8gHkUg
InChI InChI=1S/C22H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22(25)26-3)21(24)19(2)23/h18,21,24H,4-17H2,1-3H3/b20-18+/t21-/m1/s1
InChIKey GLIPXQAGIQSPTQ-BIZYMNTOSA-N
Mol Weight 368.6 g/mol
Molecular Formula C22H40O4
Exact Mass 368.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID c4EVwEJK4R
Name (3R,2E)-3-HYDROXY-2-HEXADECYLIDENE-4-OXO-PENTANOIC-ACID-METHYLESTER
Compound Number 10
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Formula C22H40O4
InChI InChI=1S/C22H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22(25)26-3)21(24)19(2)23/h18,21,24H,4-17H2,1-3H3/b20-18+/t21-/m1/s1
InChIKey GLIPXQAGIQSPTQ-BIZYMNTOSA-N
Literature Reference Author K.SEKI,T.SASAKI,S.WANO,K.HAGA,R.KANEKO
Literature Reference Citation PHYTOCHEM.,40,1175(1995)
Literature Reference DOI 10.1016/0031-9422(95)00399-R
Molecular Weight 368.557 g/mol
Solvent CDCl3
Source File Reference UWMS2781