Glycoside
GD047334
Name:
NoneFormula:
C13H21O5N4Smiles:
[NH3+]C[C@@H]1O[C@H](C(=O)NCCc2cnccn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=CNCCc1cnccn1Sugarmoiety:
[NH3+]CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | -3.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 313.33 | Num_heavy_atoms: | 22 |
| TPSA: | 152.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD25468
Formula: C7H9ON3
Smiles:
O=CNCCc1cnccn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 151.17 | Num_heavy_atoms: | 11 |
| TPSA: | 54.88 | NumAromaticRings: | 1 |
