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BioLiP

PDB CCD ID: LAH
Number of entries in BioLiP: 1
Chemical formula: C8 H17 O8 P
InChI: InChI=1S/C8H17O8P/c1-4(2)15-17(12,13)16-7-6(10)5(9)3-14-8(7)11/h4-11H,3H2,1-2H3,(H,12,13)/t5-,6-,7+,8+/m0/s1
InChIKey: PYOXTDKMFCLRNS-RULNZFCNSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385CC(C)O[P](O)(=O)O[CH]1[CH](O)OC[CH](O)[CH]1O
OpenEye OEToolkits 1.7.6CC(C)OP(=O)(O)O[C@@H]1[C@H]([C@H](CO[C@H]1O)O)O
ACDLabs 12.01O=P(OC1C(O)C(O)COC1O)(OC(C)C)O
OpenEye OEToolkits 1.7.6CC(C)OP(=O)(O)OC1C(C(COC1O)O)O
CACTVS 3.385CC(C)O[P](O)(=O)O[C@H]1[C@H](O)OC[C@H](O)[C@@H]1O
Name:2-O-[(R)-hydroxy(propan-2-yloxy)phosphoryl]-alpha-L-arabinopyranose;
2-O-[(R)-hydroxy(propan-2-yloxy)phosphoryl]-alpha-L-arabinose;
2-O-[(R)-hydroxy(propan-2-yloxy)phosphoryl]-L-arabinose;
2-O-[(R)-hydroxy(propan-2-yloxy)phosphoryl]-arabinose
ZINC: ZINC000263620919
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)(download the PDF file).
  • 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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