Imetelstat sodium
tridecasodium;N-[3-[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-amino-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfidophosphoryl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide
Molecular Identity
Imetelstat sodium
tridecasodium;N-[3-[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-[[[(2S,3S,5R)-3-amino-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-sulfidophosphoryl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(2-amino-6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]amino]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]oxy-2-hydroxypropyl]hexadecanamide
PubChem CID: 72941968
2D Structure
Properties
C148H198N68Na13O53P13S13
Molecular Formula
4896.00
Molecular Weight
g/mol
4893.6551
Exact Mass
Da
2050
TPSA
May have limited oral absorption
32
H-Bond Donors
107
H-Bond Acceptors
11900
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Imetelstat sodiumGRN163l tridecasodium saltGRN-163l tridecasodium saltGRN 163L sodium saltImetelstat sodium [USAN]UNII-2AW48LAZ4I2AW48LAZ4IImetelstat sodium [USAN:INN]IMETELSTAT SODIUM [WHO-DD]GRN163LNSC 7542281007380-31-5Imetelstat sodium (USAN)5'-(O-(2-hydroxy-3-((1-oxohexadecyl)amino)propyl)phosphorothioate)-d(3'-amino-3'-deoxy-p-thio)(t-a-g-g-g-t-t-a-g-a-c-a-a), sodium salt (13)DNA, d(3'-amino-3'-deoxy-p-thio)(t-a-g-g-g-t-t-a-g-a-c-a-a), 5'-(o-(2-hydroxy-3-((1-oxohexadecyl)amino)propyl) hydrogen phosphorothioate), sodium salt (1:13)
Data from PubChem (NCBI)
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