basic_info |
|
| Product_Name: | BATRIDENE |
| CAS: | 56509-01-4 |
| EnglishSynonyms: | BATRIDENE |
| pro_mdlNumber: | MFCD01741756 |
| pro_acceptors: | 16 |
| pro_donors: | 10 |
| pro_smile: | Cc1cc2c(c(c(c(c2C(C)C)O)O)CC3C(=O)NC(=O)NC3=O)c(c1c4c(cc5c(c4O)c(c(c(c5C(C)C)O)O)CC6C(=O)NC(=O)NC6=O)C)O |
| InChi: | InChI=1S/C38H38N4O12/c1-11(2)21-15-7-13(5)23(29(45)25(15)17(27(43)31(21)47)9-19-33(49)39-37(53)40-34(19)50)24-14(6)8-16-22(12(3)4)32(48)28(44)18(26(16)30(24)46)10-20-35(51)41-38(54)42-36(20)52/h7-8,11-12,19-20,43-48H,9-10H2,1-6H3,(H2,39,40,49,50,53)(H2,41,42,51,52,54) |
| InChiKey: | InChIKey=NLDXMTHULUKKCA-UHFFFAOYSA-N |
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