Glycoside
GD075220
Name:
NoneFormula:
C17H23O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CC[C@](O)(C5CC5)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OC1(C2CC2)CCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 377.4 | Num_heavy_atoms: | 27 |
| TPSA: | 136.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD34836
Formula: C12H14ON5
Smiles:
OC1(C2CC2)CCN(c2ncnc3c2N=C[N]3)C1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.28 | Num_heavy_atoms: | 18 |
| TPSA: | 75.71 | NumAromaticRings: | 1 |
