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PATELLIN-1

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PATELLIN-1
SpectraBase Compound ID EeJdTVFz0zD
InChI InChI=1S/C37H60N6O7S/c1-13-36(9,10)49-22(7)28-32(46)41-27(21(5)6)31(45)38-24-16-15-17-43(35(24)48)29(23(8)50-37(11,12)14-2)33(47)39-25(18-20(3)4)34-40-26(19-51-34)30(44)42-28/h13-14,20-29H,1-2,15-19H2,3-12H3,(H,38,45)(H,39,47)(H,41,46)(H,42,44)
InChIKey MCFCYSXAWNYYIF-UHFFFAOYSA-N
Mol Weight 733.0 g/mol
Molecular Formula C37H60N6O7S
Exact Mass 732.424419 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1hnz3ZCKP68
Name PATELLIN-1
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H60N6O7S
InChI InChI=1S/C37H60N6O7S/c1-13-36(9,10)49-22(7)28-32(46)41-27(21(5)6)31(45)38-24-16-15-17-43(35(24)48)29(23(8)50-37(11,12)14-2)33(47)39-25(18-20(3)4)34-40-26(19-51-34)30(44)42-28/h13-14,20-29H,1-2,15-19H2,3-12H3,(H,38,45)(H,39,47)(H,41,46)(H,42,44)
InChIKey MCFCYSXAWNYYIF-UHFFFAOYSA-N
Literature Reference Author A.R.CARROLL,J.C.COLL,D.J.BOURNE,J.K.MACLEOD,T.M.ZABRISKIE,C. M.IRELAND,B.F.BOWDEN
Literature Reference Citation AUSTR.J.CHEM.,49,659(1996)
Molecular Weight 732.979 g/mol
Solvent C6D6
Source File Reference UWRK2091