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STIGMAST-4-EN-6-ALPHA-OL-3-ONE
SpectraBase Compound ID 2c4zVbpzrf6
InChI InChI=1S/C29H48O2/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/h16,18-20,22-25,27,31H,7-15,17H2,1-6H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-/m1/s1
InChIKey IWNCBADONFSAAW-INTYXVNUSA-N
Mol Weight 428.7 g/mol
Molecular Formula C29H48O2
Exact Mass 428.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HA31EaIirng
Name STIGMAST-4-EN-6-ALPHA-OL-3-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H48O2
InChI InChI=1S/C29H48O2/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/h16,18-20,22-25,27,31H,7-15,17H2,1-6H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-/m1/s1
InChIKey IWNCBADONFSAAW-INTYXVNUSA-N
Literature Reference Author M.D.GRECA,P.MONACO,L.PREVITERA
Literature Reference Citation J.NAT.PROD.,53,1430(1990)
Literature Reference DOI 10.1021/np50072a005
Molecular Weight 428.699 g/mol
Solvent CDCl3
Source File Reference UWCS23612