CAS 138624-11-0: Alendronic acid monohydrate

Formula:C₄H₁₃NO₇P₂·H₂O

InChI:InChI=1S/C4H13NO7P2.H2O/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12);1H2

InChI key:InChIKey=AQAZLLYAEFBJMU-UHFFFAOYSA-N

SMILES:O=P(O)(O)C(O)(CCCN)P(=O)(O)O.O

• Synonyms:
• Phosphonic acid, (4-amino-1-hydroxybutylidene)bis-, monohydrate
• Alendronic acid monohydrate
• Phosphonic acid, P,P′-(4-amino-1-hydroxybutylidene)bis-, hydrate (1:1)