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2-(hydroxymethyl)-6-[6-[(phenylmethyl)amino]-7-purinyl]oxane-3,4,5-triol
SpectraBase Compound ID 6O29XfEu11Q
InChI InChI=1S/C18H21N5O5/c24-7-11-13(25)14(26)15(27)18(28-11)23-9-22-17-12(23)16(20-8-21-17)19-6-10-4-2-1-3-5-10/h1-5,8-9,11,13-15,18,24-27H,6-7H2,(H,19,20,21)
InChIKey MFMRRPHRZQYKIJ-UHFFFAOYSA-N
Mol Weight 387.4 g/mol
Molecular Formula C18H21N5O5
Exact Mass 387.154269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2geEMu40OG
Name 2-(hydroxymethyl)-6-[6-[(phenylmethyl)amino]-7-purinyl]oxane-3,4,5-triol
CAS Registry Number 56159-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N5O5
InChI InChI=1S/C18H21N5O5/c24-7-11-13(25)14(26)15(27)18(28-11)23-9-22-17-12(23)16(20-8-21-17)19-6-10-4-2-1-3-5-10/h1-5,8-9,11,13-15,18,24-27H,6-7H2,(H,19,20,21)
InChIKey MFMRRPHRZQYKIJ-UHFFFAOYSA-N
Molecular Weight 387.396 g/mol
SMILES OC1C(OC(CO)C(C1O)O)[n]1c2c(ncnc2nc1)NCc1ccccc1
SPLASH splash10-00dl-9250000000-5c3ac31964386274273a
Source of Spectrum B-31-1107-0
Synonyms 2-(hydroxymethyl)-6-[6-[(phenylmethyl)amino]purin-7-yl]oxane-3,4,5-triol 2-[6-(benzylamino)purin-7-yl]-6-(hydroxymethyl)oxane-3,4,5-triol 2-[6-(benzylamino)purin-7-yl]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol 2-[6-(benzylamino)purin-7-yl]-6-methylol-tetrahydropyran-3,4,5-triol MGS-1-A02
Wiley ID 1363313