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5-Phenyl-3-(2,3,5-tribenzoyl-.beta.-ribofuranosyl)-1,3,4-oxadiazole-2(3H)-thione
SpectraBase Compound ID 1C62gdSJ66A
InChI InChI=1S/C34H26N2O8S/c37-31(23-15-7-2-8-16-23)40-21-26-27(42-32(38)24-17-9-3-10-18-24)28(43-33(39)25-19-11-4-12-20-25)30(41-26)36-34(45)44-29(35-36)22-13-5-1-6-14-22/h1-20,26-28,30H,21H2/t26-,27-,28-,30-/m1/s1
InChIKey FAUSVWQLYAWVFJ-NODMTMHWSA-N
Mol Weight 622.6 g/mol
Molecular Formula C34H26N2O8S
Exact Mass 622.140987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5mipQAm7zFR
Name 5-Phenyl-3-(2,3,5-tribenzoyl-.beta.-ribofuranosyl)-1,3,4-oxadiazole-2(3H)-thione
Alternate Name(s) (2R,3R,4R,5R)-4-(benzoyloxy)-2-[(benzoyloxy)methyl]-5-(5-phenyl-2-sulfanylidene-2,3-dihydro-1,3,4-oxadiazol-3-yl)oxolan-3-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H26N2O8S
InChI InChI=1S/C34H26N2O8S/c37-31(23-15-7-2-8-16-23)40-21-26-27(42-32(38)24-17-9-3-10-18-24)28(43-33(39)25-19-11-4-12-20-25)30(41-26)36-34(45)44-29(35-36)22-13-5-1-6-14-22/h1-20,26-28,30H,21H2/t26-,27-,28-,30-/m1/s1
InChIKey FAUSVWQLYAWVFJ-NODMTMHWSA-N
Molecular Weight 622.648 g/mol
SMILES [C@@]1(N2N=C(c3ccccc3)OC2=S)([C@@]([C@](OC(=O)c2ccccc2)([C@](O1)(COC(=O)c1ccccc1)[H])[H])(OC(=O)c1ccccc1)[H])[H]
SPLASH splash10-0002-0300901000-64fd2f4ecf87e5474b66
Source of Spectrum CV-0-361-5
Wiley ID 849161