Glycoside
GD017645
Name:
NoneFormula:
C20H26O6N8Smiles:
CCNC(=O)c1cnn(-c2nc(N[C@@H]3CCCO3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
CCNC(=O)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 474.48 | Num_heavy_atoms: | 34 |
| TPSA: | 181.7 | NumAromaticRings: | 3 |
Unique Aglycone
AD12577
Formula: C15H17O2N8
Smiles:
CCNC(=O)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1| HBA: | 10 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 341.36 | Num_heavy_atoms: | 25 |
| TPSA: | 120.42 | NumAromaticRings: | 2 |
