basic_info |
|
| Product_Name： | E 5110 |
| CAS： | 107746-52-1 |
| EnglishSynonyms： | E 5110 |
| pro_mdlNumber： | MFCD01759383 |
| pro_acceptors： | 4 |
| pro_donors： | 1 |
| pro_smile： | CC(C)(C)c1cc(cc(c1O)C(C)(C)C)/C=C/2\CCN(C2=O)OC |
| InChi： | InChI=1S/C20H29NO3/c1-19(2,3)15-11-13(12-16(17(15)22)20(4,5)6)10-14-8-9-21(24-7)18(14)23/h10-12,22H,8-9H2,1-7H3/b14-10+ |
| InChiKey： | InChIKey=NJTQENWDJVHUOX-GXDHUFHOSA-N |
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