aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00651 | 3.12 | 158.28 | C10H22O | CCCCCCCCCCO |
|
AD00652 | 1.29 | 302.46 | C16H34O3N2 | CCCCCCCCCCOC1C(N)CC(N)C(O)C1O |
|
AD00653 | 0.59 | 394.49 | C14H18O2N8S2 | CSc1nc(N)c(N=CC=Nc2c(N)nc(SC)n(C)c2=O)c(=O)n1C |
|
AD00654 | 5.15 | 435.63 | C22H50O3N3P | CCCCCCCCCCCCCCCOP(=O)(CCN(CCN)CCN)OC |
|
AD00655 | 0.66 | 128.09 | CH5O3PS | COP(=O)(O)S |
|
AD00656 | 0.44 | 284.19 | C3H10O7P2S2 | O=P(O)(S)OCC(O)COP(=O)(O)S |
|
AD00657 | 0.19 | 352.31 | C11H17O7N2PS | COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO |
|
AD00658 | 1.25 | 448.35 | C11H18O9N2P2S2 | COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)S |
|
AD00659 | 2.88 | 1112.9 | C32H44O20N8P4S4 | COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(S)OC1CC(n2ccc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)S |
|
AD00660 | 1.25 | 930.8 | C28H45O19N4P3S3 | Cc1cn(C2CC(OCCOCCOCCOCCOP(=O)(S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)(O)S)C(COP(=O)(O)S)O2)c(=O)[nH]c1=O |