CHEBI:93993 - [1-(4-hydroxyphenoxy)-1-phosphonoethyl]phosphonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [1-(4-hydroxyphenoxy)-1-phosphonoethyl]phosphonic acid
ChEBI ID CHEBI:93993
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C8H12O8P2
Net Charge 0
Average Mass 298.124
Monoisotopic Mass 298.00074
InChI InChI=1S/C8H12O8P2/c1-8(17(10,11)12,18(13,14)15)16-7-4-2-6(9)3-5-7/h2-5,9H,1H3,(H2,10,11,12)(H2,13,14,15)
InChIKey JKOCAAWWDVHWKB-UHFFFAOYSA-N
SMILES CC(OC1=CC=C(C=C1)O)(P(=O)(O)O)P(=O)(O)O
ChEBI Ontology
Outgoing [1-(4-hydroxyphenoxy)-1-phosphonoethyl]phosphonic acid (CHEBI:93993) is a 1,1-bis(phosphonic acid) (CHEBI:77383)
Manual Xref Database
LSM-4578 LINCS
View more database links