Name | Tegatrabetan |
Iupac Chemical Name | (9E,10E)-2,7-bis(((3R,5S)-3,5-dimethylpiperidin-1-yl)sulfonyl)anthracene-9,10-dione dioxime |
Synonyms | BC2059; BC-2059; BC 2059; tegavivint; Tegatrabetan, |
Molecular Formula | C28H36N4O6S2 |
Molecular Weight | 588.74 |
Smile | O=S(C1=CC2=C(C=C1)/C(C3=CC=C(S(=O)(N4C[C@H](C)C[C@H](C)C4)=O)C=C3/C2=N\O)=N\O)(N5C[C@H](C)C[C@H](C)C5)=O |
InChiKey | GAPRVZKWPDRAJA-TVRZPQSBSA-N |
InChi | InChI=1S/C28H36N4O6S2/c1-17-9-18(2)14-31(13-17)39(35,36)21-5-7-23-25(11-21)28(30-34)26-12-22(6-8-24(26)27(23)29-33)40(37,38)32-15-19(3)10-20(4)16-32/h5-8,11-12,17-20,33-34H,9-10,13-16H2,1-4H3/b29-27-,30-28+/t17-,18+,19-,20+ |
CAS Number | 1227637-23-1 |
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