Parent CDN

cas: 2228893-48-7 — see every product listed under this CAS number, including other names

Parent CDN (CAS 2228893-48-7) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas2228893-48-7
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Structural formula: {0} (CAS {1})

2-amino-9-[(1R,6R,7R,9R,14S,15R,19R,20R)-19-(6-aminopurin-9-yl)-4,12,20-trihydroxy-4-oxo-12-sulfanylidene-3,5,8,11,13,16,18-heptaoxa-4lambda5,12lambda5-diphosphatetracyclo[13.2.2.16,9.01,14]icosan-7-yl]-1H-purin-6-one (CAS 2228893-48-7) is a chemical compound with the molecular formula C21H24N10O12P2S and a molecular weight of 702.5 g/mol. IUPAC name: 2-amino-9-[(1R,6R,7R,9R,14S,15R,19R,20R)-19-(6-aminopurin-9-yl)-4,12,20-trihydroxy-4-oxo-12-sulfanylidene-3,5,8,11,13,16,18-heptaoxa-4lambda5,12lambda5-diphosphatetracyclo[13.2.2.16,9.01,14]icosan-7-yl]-1H-purin-6-one. InChIKey: SEEWBEZRJACGIX-SYXRBOSZSA-N.

Identity
Molecular formulaC21H24N10O12P2S
Molecular weight702.5 g/mol
IUPAC name2-amino-9-[(1R,6R,7R,9R,14S,15R,19R,20R)-19-(6-aminopurin-9-yl)-4,12,20-trihydroxy-4-oxo-12-sulfanylidene-3,5,8,11,13,16,18-heptaoxa-4lambda5,12lambda5-diphosphatetracyclo[13.2.2.16,9.01,14]icosan-7-yl]-1H-purin-6-one
InChIKeySEEWBEZRJACGIX-SYXRBOSZSA-N
SMILESC1[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=C(NC4=O)N)OP(=O)(OC[C@]56CO[C@H]([C@@H]5OP(=S)(O1)O)[C@@H](O6)N7C=NC8=C(N=CN=C87)N)O)O

Computed by PubChem (NCBI)

Synonyms: orb3180019

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