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IEODOMYCIN_C;(3-S,4-E,6-E,11-R)-3,11-DIHYDROXYDODECA-4,6-DIENOIC_ACID
SpectraBase Compound ID 8jFmSagLtbl
InChI InChI=1S/C12H20O4/c1-10(13)7-5-3-2-4-6-8-11(14)9-12(15)16/h2,4,6,8,10-11,13-14H,3,5,7,9H2,1H3,(H,15,16)/b4-2+,8-6+/t10-,11-/m1/s1
InChIKey LWHVEMXRYKVHKX-HKSGNEMOSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eKDm4qTIQi
Name IEODOMYCIN_C;(3-S,4-E,6-E,11-R)-3,11-DIHYDROXYDODECA-4,6-DIENOIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-10(13)7-5-3-2-4-6-8-11(14)9-12(15)16/h2,4,6,8,10-11,13-14H,3,5,7,9H2,1H3,(H,15,16)/b4-2+,8-6+/t10-,11-/m1/s1
InChIKey LWHVEMXRYKVHKX-HKSGNEMOSA-N
Literature Reference Author M.A.M.MONDOL,J.H.KIM,M.A.LEE,F.S.TAREQ,H.S.LEE,Y.J.LEE,H.J.S HIN
Literature Reference Citation J.NAT.PROD.,74,1606(2011)
Literature Reference DOI 10.1021/np200223r
Molecular Weight 228.288 g/mol
Sample ID 39037
Solvent CD3OD