Thymidylic acid pentanucleotide
基本情報
- CAS
2609-78-1- 標準SMILES
Cc1cn([C@H]2C[C@H](OP(=O)(O)OC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)C[C@@H]3O)[C@@H](COP(=O)(O)O)O2)c(=O)[nH]c1=O- InChIKey
SNADXYWGGZYVCO-OPOFJALESA-N- 分子式
- C50H67N10O36P5
- 平均分子量
- 1,539 g/mol
- 単同位体質量
- 1,538.2407535
概要
(dT)5 is an oligonucleotide comprising five deoxythymidylic acid residues linked 5'3'. It contains a thymidine 5'-monophosphate residue, a dTMP 5'-end residue and a dTMP 3'-end residue.
名称と識別子
- 優先名称
- Thymidylic acid pentanucleotide
- IUPAC
- [(2R,3S,5R)-3-[hydroxy-[[(2R,3S,5R)-3-[hydroxy-[[(2R,3S,5R)-3-[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate
名称と別名
(dT)52609-78-1thymidylic acid pentanucleotideSCHEMBL30924952CHEBI:73302DTXSID101114207deoxythymidylic acid pentanucleotide2'-deoxythymidylic acid pentanucleotideQ271404245a(2)-O-Phosphonothymidylyl-(3a(2)a5a(2))-thymidylyl-(3a(2)a5a(2))-thymidylyl-(3a(2)a5a(2))-thymidylyl-(3a(2)a5a(2))-thymidinethymidylyl-(5'->3')-thymidylyl-(5'->3')-thymidylyl-(5'->3')-thymidylyl-(5'->3')-[5']thymidylic acidthymidylyl-(5'->3')-thymidylyl-(5'->3')-thymidylyl-(5'->3')-thymidylyl-(5'->3')-5'-thymidylic acid
データベース識別子
- CAS
2609-78-1- PubChem CID
- 71306370
- DTXSID
DTXSID101114207- ChEBI
CHEBI:73302
物性
構造計算による物性
- XLogP
- -9
- 極性表面積
- 603 Ų
- 水素結合供与体数
- 12
- 水素結合受容体数
- 36
- 回転可能結合数
- 28
- 重原子数
- 101
- 形式電荷
- 0
- 複雑度
- 3,830
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