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1R,2S,5R-Menthyl 2-benzyl-2R-methoxycartbonyl-c-5S-(1'-benzoyl-1'-ethoxycarbonylprop-3'-yl)pyrrolidine-4S-carboxylate
SpectraBase Compound ID Sh0fHkOppR
InChI InChI=1S/C37H49NO7/c1-6-44-34(40)29(33(39)27-15-11-8-12-16-27)19-20-31-30(35(41)45-32-21-25(4)17-18-28(32)24(2)3)23-37(38-31,36(42)43-5)22-26-13-9-7-10-14-26/h7-16,24-25,28-32,38H,6,17-23H2,1-5H3/t25-,28+,29?,30+,31+,32-,37+/m1/s1
InChIKey PBIBHVVSLATNIY-PTNHPKPHSA-N
Mol Weight 619.8 g/mol
Molecular Formula C37H49NO7
Exact Mass 619.350903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YHowecaONi
Name 1R,2S,5R-Menthyl 2-benzyl-2R-methoxycartbonyl-c-5S-(1'-benzoyl-1'-ethoxycarbonylprop-3'-yl)pyrrolidine-4S-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H49NO7
InChI InChI=1S/C37H49NO7/c1-6-44-34(40)29(33(39)27-15-11-8-12-16-27)19-20-31-30(35(41)45-32-21-25(4)17-18-28(32)24(2)3)23-37(38-31,36(42)43-5)22-26-13-9-7-10-14-26/h7-16,24-25,28-32,38H,6,17-23H2,1-5H3/t25-,28+,29?,30+,31+,32-,37+/m1/s1
InChIKey PBIBHVVSLATNIY-PTNHPKPHSA-N
Molecular Weight 619.799 g/mol
SMILES N1[C@]([C@](C[C@]1(C(=O)OC)Cc1ccccc1)(C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)[H])(CCC(C(=O)c1ccccc1)C(=O)OCC)[H]
SPLASH splash10-004i-0300091000-735b9b87681222eda28c
Source of Spectrum F-55-1773-18
Synonyms (2R,4S,5S)-2-Benzyl-5-(3-ethoxycarbonyl-4-oxo-4-phenyl-butyl)-pyrrolidine-2,4-dicarboxylic acid 4-((1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl) ester2-methyl ester 1R,2S,5R-Menthyl 2-benzyl-2R-methoxycartbonyl-5S-(1'-benzoyl-1'-ethoxycarbonylprop-3'-yl)pyrrolidine-4S-carboxylate (2R,4S,5S)-5-(3-benzoyl-4-ethoxy-4-oxobutyl)-2-(phenylmethyl)pyrrolidine-2,4-dicarboxylic acid O2-methyl ester O4-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester 2-O-methyl 4-O-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2R,4S,5S)-5-(3-benzoyl-4-ethoxy-4-oxobutyl)-2-benzylpyrrolidine-2,4-dicarboxylate O4-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] O2-methyl (2R,4S,5S)-5-(3-benzoyl-4-ethoxy-4-oxo-butyl)-2-benzyl-pyrrolidine-2,4-dicarboxylate O2-methyl O4-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2R,4S,5S)-5-(3-ethoxycarbonyl-4-oxidanylidene-4-phenyl-butyl)-2-(phenylmethyl)pyrrolidine-2,4-dicarboxylate
Wiley ID 836715