Glycoside
GD030261
Name:
NoneFormula:
C22H32O8N4Smiles:
O=C(CCCCCn1cc(CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)nn1)NOCc1ccccc1Aglycone:
O=C(CCCCCn1cc(CO)nn1)NOCc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 13 |
| MolWt: | 480.52 | Num_heavy_atoms: | 34 |
| TPSA: | 168.42 | NumAromaticRings: | 2 |
Unique Aglycone
AD19587
Formula: C16H22O3N4
Smiles:
O=C(CCCCCn1cc(CO)nn1)NOCc1ccccc1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 10 |
| MolWt: | 318.38 | Num_heavy_atoms: | 23 |
| TPSA: | 89.27 | NumAromaticRings: | 2 |
