Glycoside
GD004392
Name:
NoneFormula:
C28H29O8N4Smiles:
COc1ccc2cc3[n+](cc2c1OCc1cn([C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)nn1)CCc1cc2c(cc1-3)OCO2Aglycone:
COc1ccc2cc3[n+](cc2c1OCC1=C[N]N=N1)CCc1cc2c(cc1-3)OCO2Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 7 |
| HBD: | 3 | FractionCSP3: | 0.39 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 549.56 | Num_heavy_atoms: | 40 |
| TPSA: | 141.43 | NumAromaticRings: | 4 |
Unique Aglycone
AD03191
Formula: C22H18O4N4
Smiles:
COc1ccc2cc3[n+](cc2c1OCC1=C[N]N=N1)CCc1cc2c(cc1-3)OCO2| HBA: | 8 | RingCount: | 6 |
| HBD: | 0 | FractionCSP3: | 0.23 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 402.41 | Num_heavy_atoms: | 30 |
| TPSA: | 79.62 | NumAromaticRings: | 3 |
