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CORIACYCLODIENIN;5S-3-[(8R,11S,12S)-(15Z,19Z)-(8,11-EPOXY-12-HYDROXY-DOTRIACONTA-15,19-DIENYL)]-5-METHYLFURAN-2(5H)-ONE
SpectraBase Compound ID C8NKFaCQ9LQ
InChI InChI=1S/C37H64O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28-35(38)36-30-29-34(41-36)27-24-21-19-20-23-26-33-31-32(2)40-37(33)39/h14-15,18,22,31-32,34-36,38H,3-13,16-17,19-21,23-30H2,1-2H3/b15-14-,22-18-/t32-,34+,35-,36-/m1/s1
InChIKey FGFWSFXBCSXBEY-OYPCTNNMSA-N
Mol Weight 572.9 g/mol
Molecular Formula C37H64O4
Exact Mass 572.480461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6VsoVU9hDWX
Name CORIACYCLODIENIN;5S-3-[(8R,11S,12S)-(15Z,19Z)-(8,11-EPOXY-12-HYDROXY-DOTRIACONTA-15,19-DIENYL)]-5-METHYLFURAN-2(5H)-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H64O4
InChI InChI=1S/C37H64O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28-35(38)36-30-29-34(41-36)27-24-21-19-20-23-26-33-31-32(2)40-37(33)39/h14-15,18,22,31-32,34-36,38H,3-13,16-17,19-21,23-30H2,1-2H3/b15-14-,22-18-/t32-,34+,35-,36-/m1/s1
InChIKey FGFWSFXBCSXBEY-OYPCTNNMSA-N
Literature Reference Author E.L.M.DASILVA,F.ROBLOT,A.CAVE
Literature Reference Citation HETEROCYCLES,45,915(1997)
Literature Reference DOI 10.3987/COM-97-7755
Molecular Weight 572.913 g/mol
Solvent CDCl3
Source File Reference UWCP4783