Glycoside
GD023739
Name:
NoneFormula:
C21H25O5N5Smiles:
CCONC(=O)CNc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](C)[C@H](O)[C@H]1OAglycone:
CCONC(=O)CNc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 7 |
| MolWt: | 427.46 | Num_heavy_atoms: | 31 |
| TPSA: | 130.76 | NumAromaticRings: | 3 |
Unique Aglycone
AD15938
Formula: C16H16O2N5
Smiles:
CCONC(=O)CNc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 6 |
| MolWt: | 310.34 | Num_heavy_atoms: | 23 |
| TPSA: | 90.24 | NumAromaticRings: | 2 |
