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(R,R,R)-7'-BROMO-N-CARBOBENZYLOXYTRYPTOPHYL-3',5'-DICHLORO-4'-METHOXYPHENYLGLYCYL-3',5'-DIIODO-4'-METHOXYPHENYLGLYCINE-METHYLESTER

View entire compound with spectra: 1 NMR

(R,R,R)-7'-BROMO-N-CARBOBENZYLOXYTRYPTOPHYL-3',5'-DICHLORO-4'-METHOXYPHENYLGLYCYL-3',5'-DIIODO-4'-METHOXYPHENYLGLYCINE-METHYLESTER
SpectraBase Compound ID Jg47x9VMBkw
InChI InChI=1S/C38H33BrCl2I2N4O8/c1-52-33-25(40)12-20(13-26(33)41)30(36(49)47-31(37(50)54-3)21-14-27(42)34(53-2)28(43)15-21)46-35(48)29(45-38(51)55-18-19-8-5-4-6-9-19)16-22-17-44-32-23(22)10-7-11-24(32)39/h4-15,17,29-31,44H,16,18H2,1-3H3,(H,45,51)(H,46,48)(H,47,49)/t29-,30-,31+/m1/s1
InChIKey ORVPTEBNOMDLAB-OLUZHXLYSA-N
Mol Weight 1078.3 g/mol
Molecular Formula C38H33BrCl2I2N4O8
Exact Mass 1075.894822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Q2JglwQmaz
Name (R,R,R)-7'-BROMO-N-CARBOBENZYLOXYTRYPTOPHYL-3',5'-DICHLORO-4'-METHOXYPHENYLGLYCYL-3',5'-DIIODO-4'-METHOXYPHENYLGLYCINE-METHYLESTER
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H33BrCl2I2N4O8
InChI InChI=1S/C38H33BrCl2I2N4O8/c1-52-33-25(40)12-20(13-26(33)41)30(36(49)47-31(37(50)54-3)21-14-27(42)34(53-2)28(43)15-21)46-35(48)29(45-38(51)55-18-19-8-5-4-6-9-19)16-22-17-44-32-23(22)10-7-11-24(32)39/h4-15,17,29-31,44H,16,18H2,1-3H3,(H,45,51)(H,46,48)(H,47,49)/t29-,30-,31+/m1/s1
InChIKey ORVPTEBNOMDLAB-OLUZHXLYSA-N
Literature Reference Author Y.YAMADA,S.ARIMA,C.OKADA,A.AKIBA,T.KAI,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,54,788(2006)
Literature Reference DOI 10.1248/cpb.54.788
Molecular Weight 1078.321 g/mol
Sample ID 54877
Solvent CDCl3