Glycoside
GD002632
Name:
NoneFormula:
C23H32O9N6Smiles:
COc1ccc(CCNCC(O)Cn2c(=O)n(C3OC(CO)[C@H](O)[C@H]3O)c3nc(N)nc(O)c32)cc1OCAglycone:
COc1ccc(CCNCC(O)Cn2c(=O)[nH]c3nc(N)nc(O)c32)cc1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 11 |
| MolWt: | 536.54 | Num_heavy_atoms: | 38 |
| TPSA: | 219.6 | NumAromaticRings: | 3 |
Unique Aglycone
AD02485
Formula: C18H24O5N6
Smiles:
COc1ccc(CCNCC(O)Cn2c(=O)[nH]c3nc(N)nc(O)c32)cc1OC| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 9 |
| MolWt: | 404.43 | Num_heavy_atoms: | 29 |
| TPSA: | 160.54 | NumAromaticRings: | 3 |
