basic_info |
|
| Product_Name： | 12-OXO PHYTODIENOIC ACID |
| CAS： | 85551-10-6 ;134002-16-7 |
| EnglishSynonyms： | 12-OXO PHYTODIENOIC ACID ; 4-OXO-5ALPHA-(2Z-PENTENYL)-2-CYCLOPENTENE-1ALPHA-OCTANOIC ACID |
| pro_mdlNumber： | MFCD00216158 |
| pro_acceptors： | 3 |
| pro_donors： | 1 |
| pro_smile： | CC/C=C\C[C@H]1[C@H](C=CC1=O)CCCCCCCC(=O)O |
| InChi： | InChI=1S/C18H28O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,13-16H,2,4-6,8-12H2,1H3,(H,20,21)/b7-3-/t15-,16-/m0/s1 |
| InChiKey： | InChIKey=PMTMAFAPLCGXGK-JMTMCXQRSA-N |
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