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(1'R,2'R,3'R,4'R)-2-Amino-6-chloro-9-[3'-acetoxy-2'-bromo-4'-(triphenylmethoxymethyl)cyclopent-1'-yl]purine
SpectraBase Compound ID 6iO5TQ4yPNW
InChI InChI=1S/C32H29BrClN5O3/c1-20(40)42-28-21(17-25(26(28)33)39-19-36-27-29(34)37-31(35)38-30(27)39)18-41-32(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-16,19,21,25-26,28H,17-18H2,1H3,(H2,35,37,38)/t21-,25-,26-,28-/m1/s1
InChIKey LESWNHRFBIDGKF-ZTTVCKLPSA-N
Mol Weight 647.0 g/mol
Molecular Formula C32H29BrClN5O3
Exact Mass 645.114231 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID W2J1BUB3VH
Name (1'R,2'R,3'R,4'R)-2-Amino-6-chloro-9-[3'-acetoxy-2'-bromo-4'-(triphenylmethoxymethyl)cyclopent-1'-yl]purine
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Formula C32H29BrClN5O3
InChI InChI=1S/C32H29BrClN5O3/c1-20(40)42-28-21(17-25(26(28)33)39-19-36-27-29(34)37-31(35)38-30(27)39)18-41-32(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-16,19,21,25-26,28H,17-18H2,1H3,(H2,35,37,38)/t21-,25-,26-,28-/m1/s1
InChIKey LESWNHRFBIDGKF-ZTTVCKLPSA-N
Molecular Weight 646.973 g/mol
SMILES Nc1nc(c2c([n]([C@]3([C@]([C@](OC(=O)C)([C@](C3)(COC(c3ccccc3)(c3ccccc3)c3ccccc3)[H])[H])(Br)[H])[H])cn2)n1)Cl
SPLASH splash10-006x-4971000000-b0b9a255554e0be7474e
Source of Spectrum KC-0-3473-16
Synonyms Acetic acid [(1R,2R,3R,5R)-3-(2-amino-6-chloro-9-purinyl)-2-bromo-5-[(triphenylmethyl)oxymethyl]cyclopentyl] ester [(1R,2R,3R,5R)-3-(2-amino-6-chloropurin-9-yl)-2-bromo-5-(trityloxymethyl)cyclopentyl] acetate [(1R,2R,3R,5R)-3-(2-amino-6-chloro-purin-9-yl)-2-bromo-5-(trityloxymethyl)cyclopentyl] acetate [(1R,2R,3R,5R)-3-(2-azanyl-6-chloranyl-purin-9-yl)-2-bromanyl-5-[(triphenylmethyl)oxymethyl]cyclopentyl] ethanoate
Wiley ID 829696