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ACETYLARANOTIN
SpectraBase Compound ID F1kZzgcKtUd
InChI InChI=1S/C24H26N2O8S2/c1-13(27)33-17-5-7-31-11-15-9-23(35-3)22(30)26-20-16(12-32-8-6-18(20)34-14(2)28)10-24(26,36-4)21(29)25(23)19(15)17/h5-8,11-12,17-20H,9-10H2,1-4H3/t17-,18-,19-,20-,23+,24+/m1/s1
InChIKey MNIWVYZRLOFLBX-LQCNHDFWSA-N
Mol Weight 534.6 g/mol
Molecular Formula C24H26N2O8S2
Exact Mass 534.113058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BwdZjePdM63
Name ACETYLARANOTIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26N2O8S2
InChI InChI=1S/C24H26N2O8S2/c1-13(27)33-17-5-7-31-11-15-9-23(35-3)22(30)26-20-16(12-32-8-6-18(20)34-14(2)28)10-24(26,36-4)21(29)25(23)19(15)17/h5-8,11-12,17-20H,9-10H2,1-4H3/t17-,18-,19-,20-,23+,24+/m1/s1
InChIKey MNIWVYZRLOFLBX-LQCNHDFWSA-N
Literature Reference Author Z.LIN,T.ZHU,Y.FANG,Q.GU
Literature Reference Citation MAGN.RES.CHEM.,46,1212(2008)
Literature Reference DOI 10.1002/mrc.2341
Molecular Weight 534.599 g/mol
Solvent CDCl3
Source File Reference UWBT16496