Glycoside
GD077630
Name:
NoneFormula:
C19H21O5N5Smiles:
O=c1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(N/C=C/Cc2ccccc2)[nH]1Aglycone:
O=c1nc2c(c(NC=CCc3ccccc3)[nH]1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 399.41 | Num_heavy_atoms: | 29 |
| TPSA: | 145.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD35522
Formula: C14H12ON5
Smiles:
O=c1nc2c(c(NC=CCc3ccccc3)[nH]1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 266.28 | Num_heavy_atoms: | 20 |
| TPSA: | 84.24 | NumAromaticRings: | 2 |
