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SALIGNARINE-E;(20S)-20-(DIMETHYLAMINO)-3-BETA-(TIGLOYLAMINO)-PREGN-4-ENE
SpectraBase Compound ID IqSrCmGWrkq
InChI InChI=1S/C28H46N2O/c1-8-18(2)26(31)29-21-13-15-27(4)20(17-21)9-10-22-24-12-11-23(19(3)30(6)7)28(24,5)16-14-25(22)27/h8,17,19,21-25H,9-16H2,1-7H3,(H,29,31)/b18-8+/t19-,21-,22-,23+,24-,25-,27-,28+/m0/s1
InChIKey PKBOVSZNYCEPIO-FMOGVYJDSA-N
Mol Weight 426.7 g/mol
Molecular Formula C28H46N2O
Exact Mass 426.361014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JunGSLanYRZ
Name SALIGNARINE-E;(20S)-20-(DIMETHYLAMINO)-3-BETA-(TIGLOYLAMINO)-PREGN-4-ENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H46N2O
InChI InChI=1S/C28H46N2O/c1-8-18(2)26(31)29-21-13-15-27(4)20(17-21)9-10-22-24-12-11-23(19(3)30(6)7)28(24,5)16-14-25(22)27/h8,17,19,21-25H,9-16H2,1-7H3,(H,29,31)/b18-8+/t19-,21-,22-,23+,24-,25-,27-,28+/m0/s1
InChIKey PKBOVSZNYCEPIO-FMOGVYJDSA-N
Literature Reference Author A.U.RAHMAN,M.I.CHOUDHARY,M.R.KHAN,S.ANJUM,A.FAROOQ,M.Z.IQBAL
Literature Reference Citation J.NAT.PROD.,63,1364(2000)
Literature Reference DOI 10.1021/np990108w
Molecular Weight 426.686 g/mol
Solvent CDCl3
Source File Reference UWRU2180