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Adenosine Impurity (2'-O-MB-CAMP)

CAT: 1596-AR-A01447-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAS Number
55443-13-5
Synonyms
Sodium (4aS,6R,7R) -6- (6-amino-9H-purin-9-yl) -7- (butyryloxy) tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide
Molecular Formula
C14H17N5O7P.Na
Molecular Weight
398.29 22.99
API Name
Adenosyl-L-Methionine

Chemical Information

2'-O-MB-cAMP (sodium)
CAS Number55443-13-5
PubChem CID44755108
IUPAC Namesodium [(4aR,6R,7R,7aR)-6-(6-aminopurin-9-yl)-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl] butanoate
Molecular FormulaC14H17N5NaO7P
Molecular Weight421.28
Topological Polar Surface Area164
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity633
SMILES
CCCC(=O)O[C@@H]1[C@H]2[C@@H](COP(=O)(O2)[O-])O[C@H]1N3C=NC4=C(N=CN=C43)N.[Na+]
InChI
InChI=1S/C14H18N5O7P.Na/c1-2-3-8(20)25-11-10-7(4-23-27(21,22)26-10)24-14(11)19-6-18-9-12(15)16-5-17-13(9)19;/h5-7,10-11,14H,2-4H2,1H3,(H,21,22)(H2,15,16,17);/q;+1/p-1/t7-,10-,11-,14-;/m1./s1
InChIKey
GIHLXWZLZUNUHO-HOLUKZPASA-M
Chemical Structure
2D Structure
2D structure of 2'-O-MB-cAMP (sodium)
CAS: 55443-13-5
CID: 44755108
Formula: C14H17N5NaO7P
MW: 421.28
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight421.28
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count5
Exact Mass421.07632918
Monoisotopic Mass421.07632918
Topological Polar Surface Area164 Ų
Heavy Atom Count28
Formal Charge0
Complexity633
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
RM-A555955-01Adenosine Impurity 55 (2'-O-Mb-Camp)
MBS256440-012'- O- (2- Aminoethylcarbamoyl)adenosine- 3', 5'- cyclic monophosphate (2'-AEC-cAMP / 2'-EDA-cAMP)
A 098-252'- O- (2- Aminoethylcarbamoyl) adenosine- 3', 5'- cyclic monophosphate (2'-AEC-cAMP)
MBS58272382'-O-Hexadecanyl adenosine
TRC-M276150-5MG2'-O-Methyl Adenosine
A 046-252'- O- (6- Aminohexylcarbamoyl) adenosine- 3', 5'- cyclic monophosphate (2'-AHC-cAMP)
MBS256266-012'- O- (6- Aminohexylcarbamoyl)adenosine- 3', 5'- cyclic monophosphate (2'-AHC-cAMP)
HY-1546202′-O-Hexadecyl-adenosine
MBS256236-012'- O- (N- Methylanthraniloyl)adenosine- 3', 5'- cyclic monophosphate (MANT-cAMP)
TNU0047-012'-O- (2-Methoxyethyl) adenosine

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