Glycoside
GD076642
Name:
NoneFormula:
C18H21O5N5Smiles:
O=c1nc2c(ncn2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(NCCc2ccccc2)[nH]1Aglycone:
O=c1nc2c(c(NCCc3ccccc3)[nH]1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 387.4 | Num_heavy_atoms: | 28 |
| TPSA: | 145.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD35289
Formula: C13H12ON5
Smiles:
O=c1nc2c(c(NCCc3ccccc3)[nH]1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 254.27 | Num_heavy_atoms: | 19 |
| TPSA: | 84.24 | NumAromaticRings: | 2 |
