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CHEBI:43458 - [(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID

Default Structure
ChEBI IDCHEBI:43458
ChEBI Name[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID
Stars
Last Modified18 October 2009
DownloadsMolfile
FormulaC10H12N2O6P2
Net Charge0
Average Mass318.162
Monoisotopic Mass318.01706
SMILES[H]OP(=O)(O[H])C([H])(N([H])c1nc([H])c([H])c2c([H])c([H])c([H])c([H])c12)P(=O)(O[H])O[H]
InChIInChI=1S/C10H12N2O6P2/c13-19(14,15)10(20(16,17)18)12-9-8-4-2-1-3-7(8)5-6-11-9/h1-6,10H,(H,11,12)(H2,13,14,15)(H2,16,17,18)
InChIKeyJPVMIOWESIQIGB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID (CHEBI:43458) is a unclassifieds (CHEBI:27189)
Synonyms  Source
[(isoquinolin-1-ylamino)methanediyl]bis(phosphonic acid)PDBeChem
[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACIDPDBeChem
Manual XrefsDatabases
IMBPDBeChem