basic_info |
|
| Product_Name： | ARNOTTININ |
| CAS： | 53004-79-8 |
| EnglishSynonyms： | ARNOTTININ |
| pro_mdlNumber： | MFCD06796681 |
| pro_acceptors： | 4 |
| pro_donors： | 2 |
| pro_smile： | C/C(=C/Cc1c(ccc2c1oc(=O)cc2)O)/CO |
| InChi： | InChI=1S/C14H14O4/c1-9(8-15)2-5-11-12(16)6-3-10-4-7-13(17)18-14(10)11/h2-4,6-7,15-16H,5,8H2,1H3/b9-2- |
| InChiKey： | InChIKey=TXAQUMCUNALGRP-MBXJOHMKSA-N |
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