Glycoside
GD014081
Name:
NoneFormula:
C24H32O8N10Smiles:
OC[C@@H]1OC(n2cnc3c(NCCCCNc4ncnc5c4ncn5C4O[C@H](CO)[C@H](O)[C@H]4O)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCCCCNc2ncnc3c2N=C[N]3)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.58 |
| AlogP: | -2.51 | Num_rotatable_bonds: | 11 |
| MolWt: | 588.58 | Num_heavy_atoms: | 42 |
| TPSA: | 251.1 | NumAromaticRings: | 4 |
Unique Aglycone
AD10417
Formula: C14H14N10
Smiles:
C1=Nc2c(ncnc2NCCCCNc2ncnc3c2N=C[N]3)[N]1| HBA: | 10 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 7 |
| MolWt: | 322.34 | Num_heavy_atoms: | 24 |
| TPSA: | 128.54 | NumAromaticRings: | 2 |
