Glycoside

GD005695
Name:
NoneFormula:
C21H28O6N8Smiles:
CCCNC(=O)c1cnn(-c2nc(N[C@@H]3CCCO3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
CCCNC(=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: | 0.57 |
AlogP: | -0.69 | Num_rotatable_bonds: | 8 |
MolWt: | 488.51 | Num_heavy_atoms: | 35 |
TPSA: | 181.7 | NumAromaticRings: | 3 |
Unique Aglycone
AD04798
Formula: C16H19O2N8
Smiles:
CCCNC(=O)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1HBA: | 10 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.44 |
AlogP: | 1.26 | Num_rotatable_bonds: | 6 |
MolWt: | 355.38 | Num_heavy_atoms: | 26 |
TPSA: | 120.42 | NumAromaticRings: | 2 |