Glycoside
GD058409
Name:
NoneFormula:
C16H26O5N3Smiles:
O=C[C@H](NC1CCN(c2cc[nH+]cc2)CC1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CCN(c2cc[nH+]cc2)CC1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 8 |
| MolWt: | 340.4 | Num_heavy_atoms: | 24 |
| TPSA: | 127.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD29203
Formula: C10H16N3
Smiles:
NC1CCN(c2cc[nH+]cc2)CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.26 | Num_heavy_atoms: | 13 |
| TPSA: | 43.4 | NumAromaticRings: | 1 |
