BioLiP

PDB

BioLiP

PDB CCD ID:

MRP

Number of entries in BioLiP:

Chemical formula:

C7 H14 O5

InChI:

InChI=1S/C7H14O5/c1-3-4(8)6(11-2)5(9)7(10)12-3/h3-10H,1-2H3/t3-,4-,5+,6+,7+/m0/s1

InChIKey:

OEKPKBBXXDGXNB-PAMBMQIZSA-N

SMILES:

Software	SMILES
CACTVS 3.341	CO[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O)[C@@H]1O
ACDLabs 10.04	O(C1C(O)C(OC(O)C1O)C)C
OpenEye OEToolkits 1.5.0	CC1C(C(C(C(O1)O)O)OC)O
OpenEye OEToolkits 1.5.0	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O)O)OC)O
CACTVS 3.341	CO[CH]1[CH](O)[CH](C)O[CH](O)[CH]1O

Name:

3-O-methyl-alpha-L-rhamnopyranose;
3-O-METHYL-ALPHA-L-RHAMNOPYRANOSIDE;
6-deoxy-3-O-methyl-alpha-L-mannopyranose;
3-O-methyl-alpha-L-rhamnose;
3-O-methyl-L-rhamnose;
3-O-methyl-rhamnose

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).