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N-[(N-BENZYLOXYCARBONYL-O(ALPHA)-BENZYL-(S)-GLUTAMOYL)-(2RS)-(+/-)-2-AMINO-(DIETHOXYPHOSPHINYL)-ACETYL]-GLYCINE-TERT.-BUTYLESTER
SpectraBase Compound ID 7k1KZnjRALp
InChI InChI=1S/C64H86N6O22P2/c1-9-87-93(81,88-10-2)57(69-51(71)35-33-49(59(77)83-41-45-25-17-13-18-26-45)67-61(79)85-43-47-29-21-15-22-30-47)55(75)65-39-53(73)91-63(5,6)37-38-64(7,8)92-54(74)40-66-56(76)58(94(82,89-11-3)90-12-4)70-52(72)36-34-50(60(78)84-42-46-27-19-14-20-28-46)68-62(80)86-44-48-31-23-16-24-32-48/h13-32,49-50,57-58H,9-12,33-44H2,1-8H3,(H,65,75)(H,66,76)(H,67,79)(H,68,80)(H,69,71)(H,70,72)
InChIKey GDZCCZOCHCYVQV-UHFFFAOYSA-N
Mol Weight 1353.4 g/mol
Molecular Formula C64H86N6O22P2
Exact Mass 1352.527042 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IA4riUtU0zb
Name N-[(N-BENZYLOXYCARBONYL-O(ALPHA)-BENZYL-(S)-GLUTAMOYL)-(2RS)-(+/-)-2-AMINO-(DIETHOXYPHOSPHINYL)-ACETYL]-GLYCINE-TERT.-BUTYLESTER
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C64H86N6O22P2
InChI InChI=1S/C64H86N6O22P2/c1-9-87-93(81,88-10-2)57(69-51(71)35-33-49(59(77)83-41-45-25-17-13-18-26-45)67-61(79)85-43-47-29-21-15-22-30-47)55(75)65-39-53(73)91-63(5,6)37-38-64(7,8)92-54(74)40-66-56(76)58(94(82,89-11-3)90-12-4)70-52(72)36-34-50(60(78)84-42-46-27-19-14-20-28-46)68-62(80)86-44-48-31-23-16-24-32-48/h13-32,49-50,57-58H,9-12,33-44H2,1-8H3,(H,65,75)(H,66,76)(H,67,79)(H,68,80)(H,69,71)(H,70,72)
InChIKey GDZCCZOCHCYVQV-UHFFFAOYSA-N
Literature Reference Author T.KUNZE
Literature Reference Citation ARCH.PHARM.,329,503(1996)
Literature Reference DOI 10.1002/ardp.19963291106
Molecular Weight 1353.361 g/mol
Solvent CDCl3