BioLiP

PDB

BioLiP

PDB CCD ID:

U34

Number of entries in BioLiP:

Chemical formula:

C10 H15 N2 O9 P

InChI:

InChI=1S/C10H15N2O9P/c13-5-1-2-12(10(17)11-5)9-8(16)7(15)4(21-9)3-6(14)22(18,19)20/h1-2,4,6-9,14-16H,3H2,(H,11,13,17)(H2,18,19,20)/t4-,6+,7-,8-,9-/m1/s1

InChIKey:

FLYSTTLIYFQZMI-PMPOVCSBSA-N

SMILES:

Software	SMILES
CACTVS 3.341	O[C@H](C[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=CC(=O)NC2=O)[P](O)(O)=O
CACTVS 3.341	O[CH](C[CH]1O[CH]([CH](O)[CH]1O)N2C=CC(=O)NC2=O)[P](O)(O)=O
ACDLabs 10.04	O=C1NC(=O)N(C=C1)C2OC(C(O)C2O)CC(O)P(=O)(O)O
OpenEye OEToolkits 1.5.0	C1=CN(C(=O)NC1=O)C2C(C(C(O2)CC(O)P(=O)(O)O)O)O
OpenEye OEToolkits 1.5.0	C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CC(O)P(=O)(O)O)O)O

Name:

URIDINE 5'-MONOMETHYLPHOSPHATE

ZINC:

ZINC000098209483

Reference:

Chengxin Zhang, Xi Zhang, Lydia 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).