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anti-(S)-2-{(R)-[N-Phenyl-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-(2',4',6'-trimethylphenyl)methyl}butano-4-lactone
SpectraBase Compound ID 6VR6Eo0rzzE
InChI InChI=1S/C34H36N2O5/c1-20-18-21(2)27(22(3)19-20)28(26-16-17-41-33(26)40)35(23-12-8-7-9-13-23)32(39)29(34(4,5)6)36-30(37)24-14-10-11-15-25(24)31(36)38/h7-15,18-19,26,28-29H,16-17H2,1-6H3/t26-,28+,29+/m0/s1
InChIKey ITORTBAIUDYBJF-WIIGKZCBSA-N
Mol Weight 552.7 g/mol
Molecular Formula C34H36N2O5
Exact Mass 552.262422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ngX3NNhywL
Name anti-(S)-2-{(R)-[N-Phenyl-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-(2',4',6'-trimethylphenyl)methyl}butano-4-lactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H36N2O5
InChI InChI=1S/C34H36N2O5/c1-20-18-21(2)27(22(3)19-20)28(26-16-17-41-33(26)40)35(23-12-8-7-9-13-23)32(39)29(34(4,5)6)36-30(37)24-14-10-11-15-25(24)31(36)38/h7-15,18-19,26,28-29H,16-17H2,1-6H3/t26-,28+,29+/m0/s1
InChIKey ITORTBAIUDYBJF-WIIGKZCBSA-N
Molecular Weight 552.671 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@](C(N([C@]([C@]1(C(OCC1)=O)[H])(c1c(cc(cc1C)C)C)[H])c1ccccc1)=O)(C(C)(C)C)[H])=O
SPLASH splash10-014i-0093020000-a93cb5bd8f89a74cc71f
Source of Spectrum QE-6-2040-13
Synonyms (2S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{(R)-mesityl[(3S)-2-oxotetrahydro-3-furanyl]methyl}-3,3-dimethyl-N-phenylbutanamide
Wiley ID 844755