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DU4

Summary
Name:2',5'-dideoxy-5'-[(diphenylmethyl)(methyl)amino]uridine
Formula:C23 H25 N3 O4
Formal charge:0
Formula weight:407.462 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012',5'-dideoxy-5'-[(diphenylmethyl)(methyl)amino]uridine
OpenEye OEToolkits1.7.21-[(2R,4S,5R)-5-[[(diphenylmethyl)-methyl-amino]methyl]-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C1NC(=O)N(C=C1)C2OC(C(O)C2)CN(C(c3ccccc3)c4ccccc4)C
InChIInChI1.03InChI=1S/C23H25N3O4/c1-25(22(16-8-4-2-5-9-16)17-10-6-3-7-11-17)15-19-18(27)14-21(30-19)26-13-12-20(28)24-23(26)29/h2-13,18-19,21-22,27H,14-15H2,1H3,(H,24,28,29)/t18-,19+,21+/m0/s1
InChIKeyInChI1.03GMULPQZINUAVEX-QKNQBKEWSA-N
SMILES_CANONICALCACTVS3.370CN(C[C@H]1O[C@H](C[C@@H]1O)N2C=CC(=O)NC2=O)C(c3ccccc3)c4ccccc4
SMILESCACTVS3.370CN(C[CH]1O[CH](C[CH]1O)N2C=CC(=O)NC2=O)C(c3ccccc3)c4ccccc4
SMILES_CANONICALOpenEye OEToolkits1.7.2C[N@](C[C@@H]1[C@H](C[C@@H](O1)N2C=CC(=O)NC2=O)O)C(c3ccccc3)c4ccccc4
SMILESOpenEye OEToolkits1.7.2CN(CC1C(CC(O1)N2C=CC(=O)NC2=O)O)C(c3ccccc3)c4ccccc4

221716

PDB entries from 2024-06-26

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