C#C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cc(I)c2c(N)ncnc21
名称: (2R,3R,4R,5R)-2-(4-amino-5-iodo-pyrrolo[2,3-d]pyrimidin-7-yl)-3-ethynyl-5-hydroxymethyl-tetrahydrofuran-3,4-diol
IUPAC: (2R,3R,4R,5R)-2-(4-amino-5-iodopyrrolo[2,3-d]pyrimidin-7-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol
SMILES: C#C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cc(I)c2c(N)ncnc21
Canonical SMILES: C#CC1(C(C(OC1N2C=C(C3=C(N=CN=C32)N)I)CO)O)O
分子式: C13H13IN4O4
分子量: 416.17
InChIKey: OTKFJZYIJXGNPS-NHULRPGXSA-N
InChI: InChI=1S/C13H13IN4O4/c1-2-13(21)9(20)7(4-19)22-12(13)18-3-6(14)8-10(15)16-5-17-11(8)18/h1,3,5,7,9,12,19-21H,4H2,(H2,15,16,17)/t7-,9-,12-,13-/m1/s1
PubChem CID: 24962646

同義語

SCHEMBL1737291OTKFJZYIJXGNPS-NHULRPGXSA-N(2R,3R,4R,5R)-2-(4-amino-5-iodo-pyrrolo[2,3-d]pyrimidin-7-yl)-3-ethynyl-5-hydroxymethyl-tetrahydrofuran-3,4-diol
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