6-Thioinosine 2',3',5'-triacetate (2R,3R,4R,5R)-2-(乙酰氧基甲基)-5-(6-巯基-9H-嘌呤-9-基)四氢呋喃-3,4-二乙酸二酯

CAS 3021-21-4 MFCD03021214

化学结构图

3021-21-4
SMILES: CC(=O)OC[C@H]1O[C@@H](n2cnc3c(S)ncnc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O

化学属性

Mol. Weight410.40
Mol. FormulaC16H18N4O7S
Melting Point214-216 °C
Boiling Point622.3±65.0 °C at 760 mmHg

别名和识别编码

Chemical Name Translation(2R,3R,4R,5R)-2-(乙酰氧基甲基)-5-(6-巯基-9H-嘌呤-9-基)四氢呋喃-3,4-二乙酸二酯
InChIKeyMENHRYRSGYYUJA-XNIJJKJLSA-N
Chemical Name6-Thioinosine 2',3',5'-triacetate
MDL NumberMFCD00047243
CAS Number3021-21-4
PubChem Substance ID3034681
InChIInChI=1S/C16H18N4O7S/c1-7(21)24-4-10-12(25-8(2)22)13(26-9(3)23)16(27-10)20-6-19-11-14(20)17-5-18-15(11)28/h5-6,10,12-13,16H,4H2,1-3H3,(H,17,18,28)/t10-,12-,13-,16-/m1/s1
Synonym (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {} {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {} {} {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {} {} {} {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {} {} {} {} {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-mercapto-9H-purin-9-yl)tetrahydrofuran-3,4
Canonical SMILESSC(N=CN=C12)=C1N=CN2[C@H]3[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O3
LabNetwork Molecule IDLN04621016
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