Glycoside
GD091017
Name:
NoneFormula:
C21H32O5N6Smiles:
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
CCCCNC(=O)C1CCC(C)N(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 448.52 | Num_heavy_atoms: | 32 |
| TPSA: | 145.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD39647
Formula: C16H23ON6
Smiles:
CCCCNC(=O)C1CCC(C)N(c2ncnc3c2N=C[N]3)C1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.4 | Num_heavy_atoms: | 23 |
| TPSA: | 84.58 | NumAromaticRings: | 1 |
