CGS–21680 hydrochloride hydrate

cas: 124182-57-6 — see every product listed under this CAS number, including other names

CGS–21680 hydrochloride hydrate (CAS 124182-57-6) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 5mg. Offered by: GLPBio.

brandGLPBio
catalog numberGF15422-25mg
cas124182-57-6
size25mg
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Available pack sizes

brand size price
GLPBio 25mg 3363.22 Pln
GLPBio 5mg 1186.78 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

CGS-21680 is a derivative of adenosine in which the 5'-hydroxymethyl group is replaced by N-ethylcarboxamido and the hydrogen at position 2 on the adenine is replaced by a 4-(2-carboxyethyl)phenethylamino group. It has a role as an anti-inflammatory agent and an adenosine A2A receptor agonist. It is a member of adenosines, a monocarboxylic acid and a dicarboxylic acid monoamide. It is functionally related to an adenosine.

Source: ChEBI

Identity
Molecular formulaC23H29N7O6
Molecular weight499.5 g/mol
IUPAC name3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid
InChIKeyPAOANWZGLPPROA-RQXXJAGISA-N
SMILESCCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=C(N=C32)NCCC4=CC=C(C=C4)CCC(=O)O)N)O)O

Computed by PubChem (NCBI)

Synonyms: Cgs 21680, 2-(4-(2-Carboxyethyl)phenethylamino)-5'-N-ethylcarboxamidoadenosine, 2-[p-(2-Carboxyethyl)phenylethyl-Amino]-5'-N-Ethylcarboxamido Adenosine, PAOANWZGLPPROA-RQXXJAGISA-N, NGI, orb1685664, 2-p-(2-carboxyethyl)phenethylamino-5''''''''-N-ethylcarboxamidoadenosine
Related forms of this compound
3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid C23H29N7O6
Isomers (same molecular formula)
methyl 4-[3-[6-amino-9-[(2R,3R,4S,5S)-5-(cyclopropylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]prop-2-ynyl]piperidine-1-carboxylate C23H29N7O6
(2S)-N-[2-[[(2S)-5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-2-oxoethyl]-5-oxopyrrolidine-2-carboxamide C23H29N7O6

Also listed as

CGS-21680 HYDROCHLORIDE HYDRATE Sigma-Aldrich CAS 124182-57-6
4-[2-[[6-Amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]benzenepropanoic acid Chemat CAS 124182-57-6