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SMILES: C1C(=O)O[Ca]OC(=O)CN1CCN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O.[Na+].[Na+].[Na+] Canonical SMILES: [O-]C(=O)CN(CCN1CC(=O)O[Ca]OC(=O)C1)CCN(CC(=O)[O-])CC(=O)[O-].O.[Na+].[Na+].[Na+] InChI: InChI=1S/C14H23N3O10.Ca.3Na.H2O/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;;;1H2/q;+2;3*+1;/p-5 InChIKey: AWBWYUNJDQLQGT-UHFFFAOYSA-I
CBID:152156 http://www.chembase.cn/molecule-152156.html