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SMILES: C1[C@H](CC[C@@H](C1)[C@H]1CC[C@@H](CC1)CCC)C(=O)O Canonical SMILES: CCC[C@@H]1CC[C@H](CC1)[C@@H]1CC[C@H](CC1)C(=O)O InChI: InChI=1S/C16H28O2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h12-15H,2-11H2,1H3,(H,17,18)/t12-,13-,14-,15- InChIKey: JXPGQFKJNKWDKP-KTSLABGISA-N
CBID:177034 http://www.chembase.cn/molecule-177034.html