Glycoside
GD018805
Name:
NoneFormula:
C26H18O6N3F3Smiles:
O=C1NC(=O)c2c1c1c3cc(F)ccc3[nH]c1c1c2c2cc(F)ccc2n1C1OC(CF)C(O)C(O)C1OAglycone:
O=C1NC(=O)c2c1c1c3cc(F)ccc3[nH]c1c1[nH]c3ccc(F)cc3c21Sugarmoiety:
OC1OC(CF)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.23 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 525.44 | Num_heavy_atoms: | 38 |
| TPSA: | 136.81 | NumAromaticRings: | 5 |
Unique Aglycone
AD06184
Formula: C20H9O2N3F2
Smiles:
O=C1NC(=O)c2c1c1c3cc(F)ccc3[nH]c1c1[nH]c3ccc(F)cc3c21| HBA: | 5 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 4.12 | Num_rotatable_bonds: | 0 |
| MolWt: | 361.31 | Num_heavy_atoms: | 27 |
| TPSA: | 77.75 | NumAromaticRings: | 5 |
