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SMILES: C1=C[C@@]2([C@]3([C@H]([C@H]1O)[C@]([C@@H](CC3)C)(CCc1cocc1)C)C2)C(=O)OC Canonical SMILES: COC(=O)[C@]12C=C[C@@H]([C@H]3[C@@]2(C1)CC[C@H]([C@]3(C)CCc1cocc1)C)O InChI: InChI=1S/C21H28O4/c1-14-4-9-20-13-21(20,18(23)24-3)10-6-16(22)17(20)19(14,2)8-5-15-7-11-25-12-15/h6-7,10-12,14,16-17,22H,4-5,8-9,13H2,1-3H3/t14-,16+,17-,19+,20+,21+/m1/s1 InChIKey: SMHNYOMQXSRPAD-OWHLRFHBSA-N
CBID:305733 http://www.chembase.cn/molecule-305733.html