Glycoside
GD003465
Name:
NoneFormula:
C25H24O5N8SSmiles:
OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C=NNc1ncnc2c1cnn2-c1ncnc2sc3c(c12)-c1ccccc1CC3Aglycone:
C=NNc1ncnc2c1cnn2-c1ncnc2sc3c(c12)-c1ccccc1CC3Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.28 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 8 |
| MolWt: | 548.59 | Num_heavy_atoms: | 39 |
| TPSA: | 194.92 | NumAromaticRings: | 5 |
Unique Aglycone
AD03155
Formula: C20H14N8S
Smiles:
C=NNc1ncnc2c1cnn2-c1ncnc2sc3c(c12)-c1ccccc1CC3| HBA: | 8 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 3.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 398.46 | Num_heavy_atoms: | 29 |
| TPSA: | 93.77 | NumAromaticRings: | 5 |
