aglycones
Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
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AD00331 | 7.0 | 442.73 | C30H50O2 | C=C(C)C1CCC2(CO)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12 |
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AD00332 | -0.25 | 244.24 | C11H16O6 | COC(=O)C1=COC(O)C2C(C)OC(O)CC12 |
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AD00333 | 0.02 | 228.24 | C11H16O5 | COC(=O)C1=COC(O)C2C1CC(O)C2C |
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AD00334 | 2.47 | 287.4 | C15H29O4N | CCCCCCCCCCCC(=O)NC(CO)C(=O)O |
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AD00335 | 5.32 | 446.67 | C28H46O4 | COC1(CCC(C)CO)OC2CC3C4CC=C5CC(O)CCC5(C)C4CCC3(C)C2C1C |
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AD00336 | 1.95 | 116.2 | C7H16O | CCCCCCCO |
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AD00337 | 1.19 | 138.17 | C8H10O2 | COc1ccc(CO)cc1 |
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AD00338 | 6.11 | 482.71 | C31H46O4 | CC12CC(COC1=O)C1(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C1C2 |
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AD00339 | 3.9 | 240.33 | C14H12N2S | Cc1c(-c2ccccc2)[nH]c(=S)c(C#N)c1C |
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AD00340 | 3.02 | 262.33 | C13H14O2N2S | COc1ccc(C(=O)Nc2nc(C)c(C)s2)cc1 |