basic_info |
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Product_Name: | (S)-((3AS,4R,7S,7AR/3AR,4S,7R,7AS)-1,3-DIOXO-3,3A,7,7A-TETRAHYDRO-4,7-EPOXY-2-BENZOFURAN-4(1H)-YL)METHYL) ETHANETHIOATE |
EnglishSynonyms: | (S)-((3AS,4R,7S,7AR/3AR,4S,7R,7AS)-1,3-DIOXO-3,3A,7,7A-TETRAHYDRO-4,7-EPOXY-2-BENZOFURAN-4(1H)-YL)METHYL) ETHANETHIOATE |
pro_mdlNumber: | MFCD20482040 |
pro_acceptors: | 5 |
pro_donors: | 0 |
pro_smile: | CC(=O)SC[C@]12C=C[C@H](O1)[C@H]3[C@@H]2C(=O)OC3=O |
InChi: | InChI=1S/C11H10O5S/c1-5(12)17-4-11-3-2-6(16-11)7-8(11)10(14)15-9(7)13/h2-3,6-8H,4H2,1H3/t6-,7-,8+,11-/m0/s1 |
InChiKey: | InChIKey=XQOJZNDGHYALQC-SDCKUUTBSA-N |
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