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1,3,4,6-Tetra-O-acetyl-2-deoxy-2-{[4-(1H-pyrrol-1-yl)benzyl]amino}-.beta.,D-glucopyranose
SpectraBase Compound ID 9VRbv2yTm1S
InChI InChI=1S/C25H30N2O9/c1-15(28)32-14-21-23(33-16(2)29)24(34-17(3)30)22(25(36-21)35-18(4)31)26-13-19-7-9-20(10-8-19)27-11-5-6-12-27/h5-12,21-26H,13-14H2,1-4H3/t21-,22+,23-,24-,25-/m1/s1
InChIKey AZINIASFGCDOFA-QERLCLQCSA-N
Mol Weight 502.52 g/mol
Molecular Formula C25H30N2O9
Exact Mass 502.195131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID w3vXyLZkd0
Name 1,3,4,6-Tetra-O-acetyl-2-deoxy-2-{[4-(1H-pyrrol-1-yl)benzyl]amino}-.beta.,D-glucopyranose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N2O9
InChI InChI=1S/C25H30N2O9/c1-15(28)32-14-21-23(33-16(2)29)24(34-17(3)30)22(25(36-21)35-18(4)31)26-13-19-7-9-20(10-8-19)27-11-5-6-12-27/h5-12,21-26H,13-14H2,1-4H3/t21-,22+,23-,24-,25-/m1/s1
InChIKey AZINIASFGCDOFA-QERLCLQCSA-N
Molecular Weight 502.520 g/mol
SMILES N([C@]1([C@]([C@@]([C@](O[C@]1(OC(=O)C)[H])(COC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])Cc1ccc(-[n]2cccc2)cc1
SPLASH splash10-0a4i-1910000000-aaedbc79eec0222dcb7f
Source of Spectrum F4-41-984-9
Synonyms Acetic acid (2S,3S,4R,5S,6R)-4,5-diacetoxy-6-acetoxymethyl-3-(4-pyrrol-1-yl-benzylamino)-tetrahydro-pyran-2-yl ester
Wiley ID 1672213