(Q27076564)

CHEMBL490300 (English)

3 October 2016

chemical formula

C₁₈H₁₆O₈PS³⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)OC=C3)CCCC(P(=O)([O-])[O-])S(=O)(=O)[O-]

1 reference

CHEMBL490300 (English)

InChI=1S/C18H19O8PS/c19-27(20,21)18(28(22,23)24)6-2-4-13-3-1-5-15(11-13)26-16-7-8-17-14(12-16)9-10-25-17/h1,3,5,7-12,18H,2,4,6H2,(H2,19,20,21)(H,22,23,24)/p-3

3 October 2016

Identifiers

InChI

1 reference

CHEMBL490300 (English)

ILJWMHLLBUNHIQ-UHFFFAOYSA-K

3 October 2016

InChIKey

1 reference

CHEMBL490300 (English)

3 October 2016

1 reference

4-[3-(1-Benzofuran-5-yloxy)phenyl]-1-phosphonato-1-butanesulfonate (English)

3 October 2016

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

CHEMBL490300 (English)

3 October 2016

1 reference

8 February 2021

1 reference

Guide to Pharmacology Ligand ID

3123

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

3123

compound 32 [PMID: 19191557] (English)