Glycoside
GD005981
Name:
NoneFormula:
C26H18O7N2F2SSmiles:
O=C1NC(=O)c2c1c1c3cc(F)ccc3sc1c1c2c2cc(F)ccc2n1C1OC(CO)C(O)C(O)C1OAglycone:
O=C1NC(=O)c2c1c1c3cc(F)ccc3[nH]c1c1sc3ccc(F)cc3c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.23 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 2 |
| MolWt: | 540.5 | Num_heavy_atoms: | 38 |
| TPSA: | 141.25 | NumAromaticRings: | 5 |
Unique Aglycone
AD04996
Formula: C20H8O2N2F2S
Smiles:
O=C1NC(=O)c2c1c1c3cc(F)ccc3[nH]c1c1sc3ccc(F)cc3c21| HBA: | 4 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 4.85 | Num_rotatable_bonds: | 0 |
| MolWt: | 378.36 | Num_heavy_atoms: | 27 |
| TPSA: | 61.96 | NumAromaticRings: | 5 |
