Glycoside
GD032696
Name:
NoneFormula:
C22H21O8N4FSmiles:
Cc1cc2c(F)c(Oc3ncnn4cc(O[C@@H]5O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]5O)c(C)c34)ccc2[nH]1Aglycone:
Cc1cc2c(F)c(Oc3ncnn4cc(O)c(C)c34)ccc2[nH]1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 488.43 | Num_heavy_atoms: | 35 |
| TPSA: | 171.66 | NumAromaticRings: | 4 |
Unique Aglycone
AD20929
Formula: C16H13O2N4F
Smiles:
Cc1cc2c(F)c(Oc3ncnn4cc(O)c(C)c34)ccc2[nH]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.3 | Num_heavy_atoms: | 23 |
| TPSA: | 75.44 | NumAromaticRings: | 4 |
