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ACREMOFURANONE_B

View entire compound with spectra: 1 NMR

ACREMOFURANONE_B
SpectraBase Compound ID 9DiaduBYnDb
InChI InChI=1S/C23H27ClO4/c1-12-7-6-8-13(2)21-17(22(27)23(4,5)28-21)11-16-14(3)18(24)20(26)15(10-9-12)19(16)25/h8-9,11,21,25-26H,6-7,10H2,1-5H3/b12-9+,13-8+,17-11+/t21-/m1/s1
InChIKey XJTUYADTDTZVSU-MGUCUGMWSA-N
Mol Weight 402.92 g/mol
Molecular Formula C23H27ClO4
Exact Mass 402.159787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1LXMQ56cs1d
Name ACREMOFURANONE_B
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27ClO4
InChI InChI=1S/C23H27ClO4/c1-12-7-6-8-13(2)21-17(22(27)23(4,5)28-21)11-16-14(3)18(24)20(26)15(10-9-12)19(16)25/h8-9,11,21,25-26H,6-7,10H2,1-5H3/b12-9+,13-8+,17-11+/t21-/m1/s1
InChIKey XJTUYADTDTZVSU-MGUCUGMWSA-N
Literature Reference Author P.ZHANG,B.BAO,H.T.DANG,J.HONG,H.J.LEE,E.S.YOO,K.S.BAE,J.H.JU NG
Literature Reference Citation J.NAT.PROD.,72,270(2009)
Literature Reference DOI 10.1021/np8006793
Molecular Weight 402.918 g/mol
Sample ID 32199
Solvent CDCl3