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MMT

Summary
Name:5'-O-(DIMETHYLAMINO)-THYMIDINE
Formula:C12 H19 N3 O5
Formal charge:0
Formula weight:285.296 Da
Component type:DNA LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.045'-O-(dimethylamino)thymidine
OpenEye OEToolkits1.5.01-[(2R,4S,5R)-5-(dimethylaminooxymethyl)-4-hydroxy-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1NC(=O)N(C=C1C)C2OC(C(O)C2)CON(C)C
SMILES_CANONICALCACTVS3.341CN(C)OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(C)C(=O)NC2=O
SMILESCACTVS3.341CN(C)OC[CH]1O[CH](C[CH]1O)N2C=C(C)C(=O)NC2=O
SMILES_CANONICALOpenEye OEToolkits1.5.0CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CON(C)C)O
SMILESOpenEye OEToolkits1.5.0CC1=CN(C(=O)NC1=O)C2CC(C(O2)CON(C)C)O
InChIInChI1.03InChI=1S/C12H19N3O5/c1-7-5-15(12(18)13-11(7)17)10-4-8(16)9(20-10)6-19-14(2)3/h5,8-10,16H,4,6H2,1-3H3,(H,13,17,18)/t8-,9+,10+/m0/s1
InChIKeyInChI1.03MSMXDWDOLFNALA-IVZWLZJFSA-N

223532

数据于2024-08-07公开中

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