Glycoside
GD024379
Name:
NoneFormula:
C22H27O5N5Smiles:
COCCNC(=O)CNc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](C)[C@H](O)[C@H]1OAglycone:
COCCNC(=O)CNc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 8 |
| MolWt: | 441.49 | Num_heavy_atoms: | 32 |
| TPSA: | 130.76 | NumAromaticRings: | 3 |
Unique Aglycone
AD16279
Formula: C17H18O2N5
Smiles:
COCCNC(=O)CNc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.36 | Num_heavy_atoms: | 24 |
| TPSA: | 90.24 | NumAromaticRings: | 2 |
