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BioLiP

PDB CCD ID: ADU
Number of entries in BioLiP: 1
Chemical formula: C11 H15 N3 O6
InChI: InChI=1S/C11H15N3O6/c1-5(16)12-8-6(4-15)20-10(9(8)18)14-3-2-7(17)13-11(14)19/h2-3,6,8-10,15,18H,4H2,1H3,(H,12,16)(H,13,17,19)/t6-,8-,9?,10-/m1/s1
InChIKey: BUUSLPRPRSICHU-JLRHVRHOSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341CC(=O)N[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO)N2C=CC(=O)NC2=O
OpenEye OEToolkits 1.5.0CC(=O)NC1C(OC(C1O)N2C=CC(=O)NC2=O)CO
CACTVS 3.341CC(=O)N[CH]1[CH](O)[CH](O[CH]1CO)N2C=CC(=O)NC2=O
OpenEye OEToolkits 1.5.0CC(=O)N[C@@H]1[C@H](O[C@H]([C@@H]1O)N2C=CC(=O)NC2=O)CO
ACDLabs 10.04O=C1NC(=O)N(C=C1)C2OC(C(NC(=O)C)C2O)CO
Name:3'-DEOXY-3'-ACETAMIDO-URIDINE;
((((3'-DEOXY-3'-URIDINYL)-AMINO)CARBONYL)METHYL)
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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