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(1S,2R,3S,4R,1'R)-(-)-2,3-Isopropylidenedioxy-4-(1'-hydroxy-1'-[(R)-.alpha.-methoxycarbonylbenzylaminomethyl]-1'-methoxycarbonylmethyl)cyclopentane-1-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(1S,2R,3S,4R,1'R)-(-)-2,3-Isopropylidenedioxy-4-(1'-hydroxy-1'-[(R)-.alpha.-methoxycarbonylbenzylaminomethyl]-1'-methoxycarbonylmethyl)cyclopentane-1-carboxylic acid methyl ester
SpectraBase Compound ID JbptAT7IaQX
InChI InChI=1S/C23H31NO9/c1-22(2)32-17-14(19(25)29-3)11-15(18(17)33-22)23(28,21(27)31-5)12-24-16(20(26)30-4)13-9-7-6-8-10-13/h6-10,14-18,24,28H,11-12H2,1-5H3/t14-,15+,16+,17+,18-,23-/m0/s1
InChIKey ATZPWBHDXSWTFP-HJOOIPNKSA-N
Mol Weight 465.5 g/mol
Molecular Formula C23H31NO9
Exact Mass 465.199882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0kOezk4Nog
Name (1S,2R,3S,4R,1'R)-(-)-2,3-Isopropylidenedioxy-4-(1'-hydroxy-1'-[(R)-.alpha.-methoxycarbonylbenzylaminomethyl]-1'-methoxycarbonylmethyl)cyclopentane-1-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31NO9
InChI InChI=1S/C23H31NO9/c1-22(2)32-17-14(19(25)29-3)11-15(18(17)33-22)23(28,21(27)31-5)12-24-16(20(26)30-4)13-9-7-6-8-10-13/h6-10,14-18,24,28H,11-12H2,1-5H3/t14-,15+,16+,17+,18-,23-/m0/s1
InChIKey ATZPWBHDXSWTFP-HJOOIPNKSA-N
Molecular Weight 465.499 g/mol
SMILES N(C[C@]([C@]1([C@]2([C@@](OC(O2)(C)C)([H])[C@](C1)(C(=O)OC)[H])[H])[H])(C(=O)OC)O)[C@@](C(=O)OC)(c1ccccc1)[H]
SPLASH splash10-014i-0200900000-390f56e55905aa1622c8
Source of Spectrum F-51-11853-27
Synonyms Methyl (3aR,4S,6R,6aS)-6-[(1R)-1-hydroxy-2-methoxy-1-({[(1R)-2-methoxy-2-oxo-1-phenylethyl]amino}methyl)-2-oxoethyl]-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxole-4-carboxylate
Wiley ID 793886