Glycoside
GD075545
Name:
NoneFormula:
C16H21O6N4ClSmiles:
CC(C)N1Cc2c(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nc(Cl)nc2C1=OAglycone:
CC(C)N1Cc2c(N)nc(Cl)nc2C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 388.81 | Num_heavy_atoms: | 26 |
| TPSA: | 148.27 | NumAromaticRings: | 1 |
Unique Aglycone
AD34999
Formula: C10H11ON4Cl
Smiles:
CC(C)N1Cc2c(N)nc(Cl)nc2C1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 226.67 | Num_heavy_atoms: | 15 |
| TPSA: | 72.11 | NumAromaticRings: | 1 |
