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SMILES: CC(c1cccc(c1)Oc1ccccc1)C(=O)O.O.[Ca] Canonical SMILES: OC(=O)C(c1cccc(c1)Oc1ccccc1)C.O.[Ca] InChI: InChI=1S/C15H14O3.Ca.H2O/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13;;/h2-11H,1H3,(H,16,17);;1H2 InChIKey: TUWXDZBTJRWTMJ-UHFFFAOYSA-N
CBID:130719 http://www.chembase.cn/molecule-130719.html