Glycoside
GD100904
Name:
NoneFormula:
C24H27O7N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cnc(OCc3ccccc3)nc2OCc2ccccc2)[C@@H](O)[C@@H]1OAglycone:
Nc1cnc(OCc2ccccc2)nc1OCc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 9 |
| MolWt: | 469.49 | Num_heavy_atoms: | 34 |
| TPSA: | 146.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD42636
Formula: C18H17O2N3
Smiles:
Nc1cnc(OCc2ccccc2)nc1OCc1ccccc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 3.22 | Num_rotatable_bonds: | 6 |
| MolWt: | 307.35 | Num_heavy_atoms: | 23 |
| TPSA: | 70.26 | NumAromaticRings: | 3 |
