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cis-Zeatin riboside monophosphate

HCID 23724752
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Basic information

CAS
125225-71-0
Standard SMILES
C/C(=C/CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)CO
InChIKey
IRILMCCKFANGJQ-BAJUWZQUSA-N
Molecular formula
C15H22N5O8P
Average molar mass
431.34 g/mol
Monoisotopic mass
431.12059967

Overview

Cis-Zeatin riboside monophosphate is a purine ribonucleoside monophosphate.

Names & identifiers

Preferred name
cis-Zeatin riboside monophosphate
IUPAC
[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-[[(Z)-4-hydroxy-3-methylbut-2-enyl]amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate
English name
cis-ZEATIN RIBOSIDE-5'-MONOPHOSPHATE SODIUM SALT (cZMP)
Molecular formula
C15H22N5O8P
Molecular weight
431.34

Names & synonyms

cis-Zeatin riboside monophosphate125225-71-0((2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-(((Z)-4-hydroxy-3-methylbut-2-en-1-yl)amino)-9H-purin-9-yl)tetrahydrofuran-2-yl)methyl dihydrogen phosphate[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-[[(Z)-4-hydroxy-3-methylbut-2-enyl]amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphateSCHEMBL29713178CHEBI:80493DTXSID701344701Cis-zeatin riboside-5'-monophosphateQ27149545cis-ZEATIN RIBOSIDE-5'-MONOPHOSPHATE SODIUM SALT (cZMP)((2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-(((Z)-4-hydroxy-3-methylbut-2-en-1-yl)amino)-9H-purin-9-yl)tetrahydrofuran-2-yl)methyldihydrogenphosphate

Database identifiers

CAS
125225-71-0
PubChem CID
23724752
DTXSID
DTXSID701344701
ChEBI
CHEBI:80493
Nikkaji
J2.380.382H

Properties

Computed structural properties

XLogP
-2.6
Topological polar surface area
192 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
12
Rotatable bonds
8
Heavy atoms
29
Formal charge
0
Complexity
636

Physicochemical properties

Boiling point
840.286 · 840.286±75.00 °C(Press: 760.00 Torr)(predicted)
Density
1.841 · 1.841±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
1.856 · 1.856±0.10(predicted)

Chemistry & industry

Additional notes

DefinitionChEBI: Cis-Zeatin riboside monophosphate is a purine ribonucleoside monophosphate.

Related reactions

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Compound notes

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