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Stigmast-4-ene-3,6-dione

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Stigmast-4-ene-3,6-dione
SpectraBase Compound ID FEkfYfiQ4L7
InChI InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,18-20,22-25H,7-15,17H2,1-6H3/t19-,20-,22-,23+,24-,25-,28+,29+/m0/s1
InChIKey UVFOCYGYACXLAY-NSCLYYRYSA-N
Mol Weight 426.7 g/mol
Molecular Formula C29H46O2
Exact Mass 426.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dv7ONa0geEM
Name STIGMAST-4-ENE-3,6-DIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H46O2
InChI InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,18-20,22-25H,7-15,17H2,1-6H3/t19-,20-,22-,23+,24-,25-,28+,29+/m0/s1
InChIKey UVFOCYGYACXLAY-NSCLYYRYSA-N
Literature Reference Author J.C.LIM,J.H.PARK,M.BUDESINSKY,A.KASAL,Y.H.HAN,B.S.KOO,S.I.LE E,D.U.LEE
Literature Reference Citation CHEM.PHARM.BULL.,53,561(2005)
Literature Reference DOI 10.1248/cpb.53.561
Molecular Weight 426.683 g/mol
Sample ID 53984
Solvent CDCl3