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1-{(2R,3R,4R,5R)-3,4-(Isopropylidenedioxy)-5-[3-(3-methyl-2,3-dihydrobenzofuran-3-yl)-2-methylenepropyloxymethyl]tetrahydrofuran-2-yl}-3-benzyl-1,2,3,4-tetrahydropyrimidin-2,4-dione
SpectraBase Compound ID JNmztwKaMQ3
InChI InChI=1S/C32H36N2O7/c1-21(16-32(4)20-38-24-13-9-8-12-23(24)32)18-37-19-25-27-28(41-31(2,3)40-27)29(39-25)33-15-14-26(35)34(30(33)36)17-22-10-6-5-7-11-22/h5-15,25,27-29H,1,16-20H2,2-4H3/t25-,27-,28-,29-,32?/m1/s1
InChIKey ZVFYPBYFHFUDRE-LMSOODDSSA-N
Mol Weight 560.6 g/mol
Molecular Formula C32H36N2O7
Exact Mass 560.252252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JxWXX2pgQz
Name 1-{(2R,3R,4R,5R)-3,4-(Isopropylidenedioxy)-5-[3-(3-methyl-2,3-dihydrobenzofuran-3-yl)-2-methylenepropyloxymethyl]tetrahydrofuran-2-yl}-3-benzyl-1,2,3,4-tetrahydropyrimidin-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36N2O7
InChI InChI=1S/C32H36N2O7/c1-21(16-32(4)20-38-24-13-9-8-12-23(24)32)18-37-19-25-27-28(41-31(2,3)40-27)29(39-25)33-15-14-26(35)34(30(33)36)17-22-10-6-5-7-11-22/h5-15,25,27-29H,1,16-20H2,2-4H3/t25-,27-,28-,29-,32?/m1/s1
InChIKey ZVFYPBYFHFUDRE-LMSOODDSSA-N
Molecular Weight 560.647 g/mol
SMILES C1(N(C=CC(N1Cc1ccccc1)=O)[C@]1([C@]2([C@](OC(O2)(C)C)([C@](O1)(COCC(CC1(c2c(cccc2)OC1)C)=C)[H])[H])[H])[H])=O
SPLASH splash10-053u-7920100000-15bd3bb23705c7a97b12
Source of Spectrum F-56-7559-6
Synonyms 1-[(3aR,4R,6R,6aR)-2,2-dimethyl-6-[({2-[(3-methyl-2,3-dihydro-1-benzofuran-3-yl)methyl]prop-2-en-1-yl}oxy)methyl]-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-3-benzyl-1,2,3,4-tetrahydropyrimidine-2,4-dione 1-{2,3-(Isopropylidenedioxy)-4-[3-(3-methyl-2,3-dihydrobenzofuran-3-yl)-2-methylenepropyloxymethyl]tetrahydrofuran-2-yl}-3-benzyl-1,2,3,4-tetrahydropyrimidin-2,4-dione
Wiley ID 858674