Adenosine-5'-carboxylic Acid
| Catalog Number | Size | Price | Stock | Quantity |
|---|---|---|---|---|
| BPM-218147 | 200 mg | $199 | In stock |
Product Information
Molecular Formula
C10H11N5O5
Molecular Weight
281.22
Description
An intermediate in the synthesis of Adenosine 5'-Monophosphate-5',5''-d2 Disodium Salt.
Synonyms
Ado-5'-cooh; 9-Riburonosyladenine; 9-beta-D-ribofuranuronosyladenine; (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxylic acid
IUPAC Name
(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxylic acid
SMILES
C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)C(=O)O)O)O
InChI
InChI=1S/C10H11N5O5/c11-7-3-8(13-1-12-7)15(2-14-3)9-5(17)4(16)6(20-9)10(18)19/h1-2,4-6,9,16-17H,(H,18,19)(H2,11,12,13)/t4-,5+,6-,9+/m0/s1
InChI Key
IBYWUFHJUDTSOC-SOVPELCUSA-N
Boiling Point
756.3°C at 760 mmHg
Purity
95%
Density
2.24 g/cm3
Appearance
White Solid
Computed Properties
XLogP3
-0.8
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
9
Rotatable Bond Count
2
Exact Mass
281.07601847 g/mol
Monoisotopic Mass
281.07601847 g/mol
Topological Polar Surface Area
157Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
398
Isotope Atom Count
0
Defined Atom Stereocenter Count
4
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
