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IOJJCNOBDVSLGW-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

IOJJCNOBDVSLGW-UHFFFAOYSA-N
SpectraBase Compound ID GLXTYxSXWaT
InChI InChI=1S/C27H45N5O9/c1-2-15-41-27(40)22-5-3-21(4-6-22)16-28-23(33)17-29-7-9-30(18-24(34)35)11-13-32(20-26(38)39)14-12-31(10-8-29)19-25(36)37/h2,21-22H,1,3-20H2,(H,28,33)(H,34,35)(H,36,37)(H,38,39)
InChIKey IOJJCNOBDVSLGW-UHFFFAOYSA-N
Mol Weight 583.7 g/mol
Molecular Formula C27H45N5O9
Exact Mass 583.321728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kczTrs1czK
Name IOJJCNOBDVSLGW-UHFFFAOYSA-N
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45N5O9
InChI InChI=1S/C27H45N5O9/c1-2-15-41-27(40)22-5-3-21(4-6-22)16-28-23(33)17-29-7-9-30(18-24(34)35)11-13-32(20-26(38)39)14-12-31(10-8-29)19-25(36)37/h2,21-22H,1,3-20H2,(H,28,33)(H,34,35)(H,36,37)(H,38,39)
InChIKey IOJJCNOBDVSLGW-UHFFFAOYSA-N
Literature Reference Author S.GU,H.K.KIM,G.H.LEE,B.S.KANG,Y.CHANG,T.J.KIM
Literature Reference Citation J.MED.CHEM.,54,143(2011)
Literature Reference DOI 10.1021/jm100966t
Molecular Weight 583.682 g/mol
Solvent D2O
Source File Reference UWMZ47133