Glycoside
GD048664
Name:
NoneFormula:
C12H19O6N3Smiles:
Cn1cc(CCNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)cn1Aglycone:
Cn1cc(CCN)cn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -3.28 | Num_rotatable_bonds: | 8 |
| MolWt: | 301.3 | Num_heavy_atoms: | 21 |
| TPSA: | 144.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD25936
Formula: C6H11N3
Smiles:
Cn1cc(CCN)cn1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 125.18 | Num_heavy_atoms: | 9 |
| TPSA: | 43.84 | NumAromaticRings: | 1 |
