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ZAD

Summary
Name:(S)-1'-(2',3'-DIHYDROXYPROPYL)-ADENINE
Formula:C8 H12 N5 O5 P
Formal charge:0
Formula weight:289.185 Da
Component type:RNA LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(2S)-3-(6-amino-9H-purin-9-yl)-2-hydroxypropyl dihydrogen phosphate
OpenEye OEToolkits1.5.0[(2S)-3-(6-aminopurin-9-yl)-2-hydroxy-propyl] dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=P(O)(O)OCC(O)Cn1c2ncnc(c2nc1)N
SMILES_CANONICALCACTVS3.341Nc1ncnc2n(C[C@H](O)CO[P](O)(O)=O)cnc12
SMILESCACTVS3.341Nc1ncnc2n(C[CH](O)CO[P](O)(O)=O)cnc12
SMILES_CANONICALOpenEye OEToolkits1.5.0c1nc(c2c(n1)n(cn2)C[C@@H](COP(=O)(O)O)O)N
SMILESOpenEye OEToolkits1.5.0c1nc(c2c(n1)n(cn2)CC(COP(=O)(O)O)O)N
InChIInChI1.03InChI=1S/C8H12N5O5P/c9-7-6-8(11-3-10-7)13(4-12-6)1-5(14)2-18-19(15,16)17/h3-5,14H,1-2H2,(H2,9,10,11)(H2,15,16,17)/t5-/m0/s1
InChIKeyInChI1.03IDXHXXLVPICOPG-YFKPBYRVSA-N

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PDB entries from 2026-02-04

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