BioLiP

PDB

BioLiP

PDB CCD ID:

R1X

Number of entries in BioLiP:

Chemical formula:

C5 H10 O4

InChI:

InChI=1S/C5H10O4/c6-1-4-5(8)3(7)2-9-4/h3-8H,1-2H2/t3-,4+,5-/m0/s1

InChIKey:

KZVAAIRBJJYZOW-LMVFSUKVSA-N

SMILES:

Software	SMILES
CACTVS 3.341	OC[C@H]1OC[C@H](O)[C@@H]1O
CACTVS 3.341	OC[CH]1OC[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0	C1C(C(C(O1)CO)O)O
OpenEye OEToolkits 1.5.0	C1[C@@H]([C@@H]([C@H](O1)CO)O)O
ACDLabs 10.04	OCC1OCC(O)C1O

Name:

1,4-anhydro-D-ribitol;
1-deoxyribose

ZINC:

ZINC000016051849

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).