Glycoside
GD011857
Name:
NoneFormula:
C20H27O5N3Smiles:
O=C(NCC1CCCCC1)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)nc2c1Aglycone:
O=C(NCC1CCCCC1)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 389.45 | Num_heavy_atoms: | 28 |
| TPSA: | 127.7 | NumAromaticRings: | 2 |
Unique Aglycone
AD08998
Formula: C15H19ON3
Smiles:
O=C(NCC1CCCCC1)c1ccc2[nH]cnc2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 2.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 257.34 | Num_heavy_atoms: | 19 |
| TPSA: | 57.78 | NumAromaticRings: | 2 |
