Glycoside
GD125627
Name:
Factor FoFormula:
C16H17O7N3Smiles:
O=c1ccc2cc3c(O)nc(O)nc3n(CC(O)C(O)C(O)CO)c-2c1Aglycone:
Cn1c2cc(=O)ccc-2cc2c(O)nc(O)nc21Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.31 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 363.33 | Num_heavy_atoms: | 26 |
| TPSA: | 169.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD50810
Formula: C12H9O3N3
Smiles:
Cn1c2cc(=O)ccc-2cc2c(O)nc(O)nc21| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 243.22 | Num_heavy_atoms: | 18 |
| TPSA: | 88.24 | NumAromaticRings: | 1 |
