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Impericine [(20R,22S,25S)-5.alpha.-cevanin-23-ene-3.beta.,6.beta.,16.beta.-triol]
SpectraBase Compound ID JTgcCAWeNrm
InChI InChI=1S/C27H43NO3/c1-14-4-5-23-15(2)26-20(13-28(23)12-14)17-9-21-19(18(17)10-25(26)31)11-24(30)22-8-16(29)6-7-27(21,22)3/h4-5,14-26,29-31H,6-13H2,1-3H3/t14-,15-,16-,17+,18+,19-,20-,21-,22+,23-,24+,25-,26+,27+/m0/s1
InChIKey BSHYJFKVJJHKEM-YHIXLZKYSA-N
Mol Weight 429.6 g/mol
Molecular Formula C27H43NO3
Exact Mass 429.324294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5gJcpdC8pNM
Name IMPERICINE;(20R,22S,25S)-5-ALPHA-CEVANIN-23-ENE-3-BETA,6-BETA,16-BETA-TRIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H43NO3
InChI InChI=1S/C27H43NO3/c1-14-4-5-23-15(2)26-20(13-28(23)12-14)17-9-21-19(18(17)10-25(26)31)11-24(30)22-8-16(29)6-7-27(21,22)3/h4-5,14-26,29-31H,6-13H2,1-3H3/t14-,15-,16-,17+,18+,19-,20-,21-,22+,23-,24+,25-,26+,27+/m0/s1
InChIKey BSHYJFKVJJHKEM-YHIXLZKYSA-N
Literature Reference Author A.U.RAHMAN,M.N.AKHTAR,M.I.CHOUDHARY,Y.TSUDA,B.SENER,A.KHALID ,M.PARVEZ
Literature Reference Citation CHEM.PHARM.BULL.,50,1013(2002)
Literature Reference DOI 10.1248/cpb.50.1013
Molecular Weight 429.643 g/mol
Solvent CDCl3
Source File Reference UWMS6627