
API0233601
Casimersen 5\'-cytosine modification
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CAS No.
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Synonyms
8CQO07490I; CASIMERSEN 5'-CYTOSINE MODIFICATION; ETEPLIRSEN 5'-CYTOSINE MODIFICATION
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CHEMBL ID
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Indications
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Molecule Type
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Compound CID
131842141
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Molecular Weight (g/mol)
577.6
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Molecular Formula
C22H40N7O9P
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InChI
InChI=1S/C22H40N7O9P/c1-26(2)39(33,37-17-18-15-24-16-20(38-18)29-4-3-19(23)25-21(29)31)28-7-5-27(6-8-28)22(32)36-14-13-35-12-11-34-10-9-30/h3-4,18,20,24,30H,5-17H2,1-2H3,(H2,23,25,31)/t18-,20+,39?/m0/s1
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InChIKey
KTQVJPYTGHFWJB-HCCSCLAOSA-N
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SMILES
CN(C)P(=O)(N1CCN(CC1)C(=O)OCCOCCOCCO)OC[C@@H]2CNC[C@@H](O2)N3C=CC(=NC3=O)N
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IUPAC Name
2-[2-(2-hydroxyethoxy)ethoxy]ethyl 4-[[(2S,6R)-6-(4-amino-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]piperazine-1-carboxylate
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Exact Mass (Da)
577.26251288
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Monoisotopic Mass (Da)
577.26251288
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