John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4EBbNxqHUBY SpectraBase Spectrum ID=Kvk6MO7Pgw2

(accessed ).
MARINOBUFAGIN
SpectraBase Compound ID 4EBbNxqHUBY
InChI InChI=1S/C24H32O5/c1-21-8-5-15(25)12-23(21,27)10-7-17-16(21)6-9-22(2)18(11-19-24(17,22)29-19)14-3-4-20(26)28-13-14/h3-4,13,15-19,25,27H,5-12H2,1-2H3/t15-,16-,17+,18+,19+,21+,22+,23-,24+/m0/s1
InChIKey JMNQTHQLNRILMH-OBBGIPBRSA-N
Mol Weight 400.5 g/mol
Molecular Formula C24H32O5
Exact Mass 400.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kvk6MO7Pgw2
Name MARINOBUFAGIN
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O5
InChI InChI=1S/C24H32O5/c1-21-8-5-15(25)12-23(21,27)10-7-17-16(21)6-9-22(2)18(11-19-24(17,22)29-19)14-3-4-20(26)28-13-14/h3-4,13,15-19,25,27H,5-12H2,1-2H3/t15-,16-,17+,18+,19+,21+,22+,23-,24+/m0/s1
InChIKey JMNQTHQLNRILMH-OBBGIPBRSA-N
Literature Reference Author W.F.REYNOLDS,A.MAXWELL,B.TELANG,K.BEDAISIE,G.RAMCHARAN
Literature Reference Citation MAGN.RES.CHEM.,33,412(1995)
Literature Reference DOI 10.1002/mrc.1260330515
Molecular Weight 400.515 g/mol
Solvent Unknown
Source File Reference UWCS22606
SpectraBase Batch ID Idq6SsvzpBi