Glycoside
GD002741
Name:
NoneFormula:
C19H27O6N7Smiles:
Cc1nc2nc3c(c(O)n2n1)n(CCN1CCCCC1)c(=O)n3C1OC(CO)[C@H](O)[C@H]1OAglycone:
Cc1nc2nc3[nH]c(=O)n(CCN4CCCCC4)c3c(O)n2n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.68 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 449.47 | Num_heavy_atoms: | 32 |
| TPSA: | 163.4 | NumAromaticRings: | 3 |
Unique Aglycone
AD02581
Formula: C14H19O2N7
Smiles:
Cc1nc2nc3[nH]c(=O)n(CCN4CCCCC4)c3c(O)n2n1| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 317.35 | Num_heavy_atoms: | 23 |
| TPSA: | 104.34 | NumAromaticRings: | 3 |
