2-Propan-2-yladenosine 5'-(dihydrogen phosphate) structure

2-Propan-2-yladenosine 5'-(dihydrogen phosphate)

[(2R,3S,4R,5R)-5-(6-amino-2-propan-2-ylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

Also Known As: Poly(2'-isopropyladenylic acid)|2-propan-2-yladenosine 5'-(dihydrogen phosphate)|5'-Adenylic acid, 2-(1-methylethyl)-, homopolymer|2-(Propan-2-yl)adenosine 5'-(dihydrogen phosphate)|9-(5-O-Phosphonopentofuranosyl)-2-(propan-2-yl)-9H-purin-6-amine|[(2R,3S,4R,5R)-5-(6-amino-2-propan-2-ylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

CAS: 7696-77-7
Molecular Formula C13H20N5O7P
Molecular Weight 389.11005 g/mol
LogP -2.4
Topological Polar Surface Area 186.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 11
Rotatable Bonds 5
Exact Mass 389.11005
Monoisotopic Mass 389.11005
Heavy Atoms 26
Complexity 551.0

Chemical Identifiers

CAS Number 7696-77-7
SMILES CC(C)C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N
InChIKey QGTFQPJASUNCSJ-HTVVRFAVSA-N

Product Overview

2-Propan-2-yladenosine 5'-(dihydrogen phosphate) (CAS 7696-77-7), with molecular formula C13H20N5O7P and molecular weight 389.11005 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-amino-2-propan-2-ylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate.

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