Glycoside
GD002312
Name:
NoneFormula:
C22H18O8NFSmiles:
O=C1c2cc3c(cc2-c2c1c1ccc(F)cc1c(=O)n2C[C@H](O)[C@H](O)[C@H](O)CO)OCO3Aglycone:
Cn1c2c(c3ccc(F)cc3c1=O)C(=O)c1cc3c(cc1-2)OCO3Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.27 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 443.38 | Num_heavy_atoms: | 32 |
| TPSA: | 138.45 | NumAromaticRings: | 3 |
Unique Aglycone
AD02219
Formula: C18H10O4NF
Smiles:
Cn1c2c(c3ccc(F)cc3c1=O)C(=O)c1cc3c(cc1-2)OCO3| HBA: | 5 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 0 |
| MolWt: | 323.28 | Num_heavy_atoms: | 24 |
| TPSA: | 57.53 | NumAromaticRings: | 3 |
