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2,4-TRANS-ISOMOLVIZARIN-1

View entire compound with spectra: 2 NMR

2,4-TRANS-ISOMOLVIZARIN-1
SpectraBase Compound ID 8s0kVJn5AAT
InChI InChI=1S/C35H62O7/c1-3-4-5-6-7-8-12-15-18-29(37)31-20-22-33(41-31)34-23-21-32(42-34)30(38)19-16-13-10-9-11-14-17-28-25-27(24-26(2)36)35(39)40-28/h27-34,37-38H,3-25H2,1-2H3/t27?,28?,29-,30-,31+,32-,33+,34-/m0/s1
InChIKey XNEFYQGSRCIPKN-MOVDTWHFSA-N
Mol Weight 594.9 g/mol
Molecular Formula C35H62O7
Exact Mass 594.449554 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3UAdNqkSuFr
Name 2,4-TRANS-ISOMOLVIZARIN-1
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H62O7
InChI InChI=1S/C35H62O7/c1-3-4-5-6-7-8-12-15-18-29(37)31-20-22-33(41-31)34-23-21-32(42-34)30(38)19-16-13-10-9-11-14-17-28-25-27(24-26(2)36)35(39)40-28/h27-34,37-38H,3-25H2,1-2H3/t27?,28?,29-,30-,31+,32-,33+,34-/m0/s1
InChIKey XNEFYQGSRCIPKN-MOVDTWHFSA-N
Literature Reference Author P.DURET,D.GROMEK,R.HOCQUEMILLER,A.CAVE,D.CORTES
Literature Reference Citation J.NAT.PROD.,57,911(1994)
Literature Reference DOI 10.1021/np50109a006
Molecular Weight 594.873 g/mol
Solvent CDCl3
Source File Reference UWTS1790