basic_info |
|
| Product_Name: | OTAVA-FLUOR OTVD_0230 |
| EnglishSynonyms: | OTAVA-FLUOR OTVD_0230 |
| pro_mdlNumber: | MFCD10001191 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | CCCCCCN(CCCCCC)c1ccc(cc1)/C=C/c2cc[n+](cc2C)CCCCS(=O)(=O)[O-] |
| InChi: | InChI=1S/C30H46N2O3S/c1-4-6-8-10-22-32(23-11-9-7-5-2)30-18-15-28(16-19-30)14-17-29-20-24-31(26-27(29)3)21-12-13-25-36(33,34)35/h14-20,24,26H,4-13,21-23,25H2,1-3H3 |
| InChiKey: | InChIKey=HCQPQPULLXYMPW-UHFFFAOYSA-N |
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