Glycoside
GD053848
Name:
NoneFormula:
C14H25O5N4Smiles:
O[C@H]1O[C@H](Cn2cc(C[NH+]3CCCCC3)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cn1cc(C[NH+]2CCCCC2)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -3.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.38 | Num_heavy_atoms: | 23 |
| TPSA: | 125.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD27442
Formula: C9H17N4
Smiles:
Cn1cc(C[NH+]2CCCCC2)nn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 181.26 | Num_heavy_atoms: | 13 |
| TPSA: | 35.15 | NumAromaticRings: | 1 |
