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(Z,4R,5S,6R)-N-2'-OXOPROPYL-2-BENZYLOXYCARBONYLAMINO-6-MONOCHLOROMETHANE-SULFONYL-4,5,7-TRIBENZYLOXY-2-HEPTENAMIDE
SpectraBase Compound ID LF6KA1zP2aE
InChI InChI=1S/C40H43ClN2O10S/c1-30(44)23-42-39(45)35(43-40(46)52-27-34-20-12-5-13-21-34)22-36(50-25-32-16-8-3-9-17-32)38(51-26-33-18-10-4-11-19-33)37(53-54(47,48)29-41)28-49-24-31-14-6-2-7-15-31/h2-22,36-38H,23-29H2,1H3,(H,42,45)(H,43,46)/b35-22-/t36-,37-,38+/m1/s1
InChIKey KOGUAMOMPULXQX-XQKVXOIKSA-N
Mol Weight 779.3 g/mol
Molecular Formula C40H43ClN2O10S
Exact Mass 778.232694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AHOkkFf3PUG
Name (Z,4R,5S,6R)-N-2'-OXOPROPYL-2-BENZYLOXYCARBONYLAMINO-6-MONOCHLOROMETHANE-SULFONYL-4,5,7-TRIBENZYLOXY-2-HEPTENAMIDE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H43ClN2O10S
InChI InChI=1S/C40H43ClN2O10S/c1-30(44)23-42-39(45)35(43-40(46)52-27-34-20-12-5-13-21-34)22-36(50-25-32-16-8-3-9-17-32)38(51-26-33-18-10-4-11-19-33)37(53-54(47,48)29-41)28-49-24-31-14-6-2-7-15-31/h2-22,36-38H,23-29H2,1H3,(H,42,45)(H,43,46)/b35-22-/t36-,37-,38+/m1/s1
InChIKey KOGUAMOMPULXQX-XQKVXOIKSA-N
Literature Reference Author Y.KONDA-YAMADA,K.ASANO,T.SATOU,S.MONMA,M.SAKAYANAGI,N.SATOU, K.TAKEDA,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,53,529(2005)
Literature Reference DOI 10.1248/cpb.53.529
Molecular Weight 779.302 g/mol
Sample ID 54078
Solvent CDCl3