HIT ID: HIT214435689
Cas No: 167105-81-9
分子式: C30H24CaN2O6
分子量: 548.608
常用名: Ketorolac hemicalcium
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: calcium bis(5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate)
IUPAC: calcium bis(5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate)
SMILES: [Ca++].[O-]C(=O)C1CCn2c1ccc2C(=O)c1ccccc1.[O-]C(=O)C1CCn2c1ccc2C(=O)c1ccccc1
SMILES: [Ca++].[O-]C(=O)C1CCn2c1ccc2C(=O)c1ccccc1.[O-]C(=O)C1CCn2c1ccc2C(=O)c1ccccc1
InChI key: NPCGTDZMTWNBDA-UHFFFAOYSA-L