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SMILES: c12C(CC(=O)O)OCCc1ccs2 Canonical SMILES: OC(=O)CC1OCCc2c1scc2 InChI: InChI=1S/C9H10O3S/c10-8(11)5-7-9-6(1-3-12-7)2-4-13-9/h2,4,7H,1,3,5H2,(H,10,11) InChIKey: HUPCAJKSCWGASO-UHFFFAOYSA-N
CBID:270312 http://www.chembase.cn/molecule-270312.html