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D-myo-Inositol, 2,4-bis-O-(phenylmethyl)-, 6-[(1-phenylethyl)carbamate], (R)-
SpectraBase Compound ID AhC8riHrXI0
InChI InChI=1S/C29H33NO7/c1-19(22-15-9-4-10-16-22)30-29(34)37-28-24(32)26(35-17-20-11-5-2-6-12-20)23(31)27(25(28)33)36-18-21-13-7-3-8-14-21/h2-16,19,23-28,31-33H,17-18H2,1H3,(H,30,34)/t19-,23-,24+,25-,26+,27+,28-/m1/s1
InChIKey UGQIHFGNYFGJQY-MILKHLMBSA-N
Mol Weight 507.6 g/mol
Molecular Formula C29H33NO7
Exact Mass 507.225702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SOm5rBDox2
Name D-myo-Inositol, 2,4-bis-O-(phenylmethyl)-, 6-[(1-phenylethyl)carbamate], (R)-
Alternate Name(s) (2R,3S,5S,6S)-3,5-bis(benzyloxy)-2,4,6-trihydroxycyclohexyl (1R)-1-phenylethylcarbamate 1-D-2,4-di-O-benzyl-6-O-{[(R)-1-phenylethyl]aminocarbonyl}-myo-inositol
CAS Registry Number 120268-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H33NO7
InChI InChI=1S/C29H33NO7/c1-19(22-15-9-4-10-16-22)30-29(34)37-28-24(32)26(35-17-20-11-5-2-6-12-20)23(31)27(25(28)33)36-18-21-13-7-3-8-14-21/h2-16,19,23-28,31-33H,17-18H2,1H3,(H,30,34)/t19-,23-,24+,25-,26+,27+,28-/m1/s1
InChIKey UGQIHFGNYFGJQY-MILKHLMBSA-N
Molecular Weight 507.583 g/mol
SMILES O[C@]1([C@]([C@@]([C@@]([C@]([C@]1(OC(N[C@@](c1ccccc1)(C)[H])=O)[H])(O)[H])(OCc1ccccc1)[H])(O)[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-001i-0900000000-53e5bea67c44ec1f28db
Source of Spectrum H-71-1374-8
Wiley ID 1400051