CAS 140712-81-8 2'-Deoxy-3'-O-DMT-N2-Isobutyrylguanosine (HCID 136334544)

基本情報

CAS: 140712-81-8
標準SMILES: COc1ccc(C(O[C@H]2C[C@H](n3cnc4c(=O)[nH]c(NC(=O)C(C)C)nc43)O[C@@H]2CO)(c2ccccc2)c2ccc(OC)cc2)cc1
InChIKey: FRMKNQDKTCCNED-ZGIBFIJWSA-N
分子式: C35H37N5O7
平均分子量: 639.7 g/mol
単同位体質量: 639.26929854

名称と識別子

優先名称: 2'-Deoxy-3'-O-DMT-N2-Isobutyrylguanosine
IUPAC: N-[9-[(2R,4S,5R)-4-[bis(4-methoxyphenyl)-phenylmethoxy]-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-1H-purin-2-yl]-2-methylpropanamide
英語名: N-Isobutyryl-3'-O-(4,4'-diMethoxytrityl)-2'-deoxyguanosine, 97%
分子式: C35H37N5O7
分子量: 639.7

名称と別名

140712-81-82'-Deoxy-3'-O-DMT-N2-IsobutyrylguanosineN-(9-((2R,4S,5R)-4-(Bis(4-methoxyphenyl)(phenyl)methoxy)-5-(hydroxymethyl)tetrahydrofuran-2-yl)-6-oxo-6,9-dihydro-1H-purin-2-yl)isobutyramideN2-isobutyryl-3'-O-(4,4'-dimethoxytrityl)-2'-deoxyguanosineN-[9-[(2R,4S,5R)-4-[bis(4-methoxyphenyl)-phenylmethoxy]-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-1H-purin-2-yl]-2-methylpropanamideSCHEMBL3820908FRMKNQDKTCCNED-ZGIBFIJWSA-NDTXSID4011312663'-O-DMT-N2-Isobutyryl-D-guanosineAKOS037621765ND06928CS-0098494

名称をさらに表示

N2-iso-Butyryl-3’-O-DMTr-2’-deoxy guanosineGuanosine, 3'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-N-(2-methyl-1-oxopropyl)-

3-O-DMTr-N2-ISOBUTYRYL-DEOXY-GUANOSINED75952N2-iso-Butyryl-3'-O-DMTr-2'-deoxy guanosine2'-Deoxy-3'-O-DMT-N2-Isobutyryl-2'-deoxyguanosineN-Isobutyryl-3'-O-(4,4'-diMethoxytrityl)-2'-deoxyguanosineN2-isobutyryl-3'-O- (4,4'-dimethoxytrityl)-2'-deoxyguanosineN-Isobutyryl-3'-O-(4,4'-diMethoxytrityl)-2'-deoxyguanosine, 97%3'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]-2'-deoxy-N-(2-methylpropanoyl)guanosine

物性

構造計算による物性

XLogP: 4.1
極性表面積: 146 Å²
水素結合供与体数: 3
水素結合受容体数: 9
回転可能結合数: 11
重原子数: 47
形式電荷: 0
複雑度: 1,080

物理化学的性質

融点: 109 · 109-110 °C
比重(密度): 1.35 · 1.35±0.1 g/cm3(Predicted)
酸解離定数(Pka): 8.68 · 8.68±0.20(Predicted)

化学と産業

応用分野

使用2''-Deoxy-3''-O-DMT-N2-Isobutyrylguanosine is a protected derivative of guanosine (G837895) used in the preparation of synthetic nucleotide phosphates and organic DNA linkers.

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化合物ノート

読み込み中…

2'-Deoxy-3'-O-DMT-N2-Isobutyrylguanosine