Glycoside
GD002512
Name:
NoneFormula:
C15H33O8N3Smiles:
CCCN[C@H]1[C@H](O)[C@@H](O)[C@@H](O[C@H]([C@H](O)CN)[C@H](N)[C@H](O)CO)O[C@H]1COAglycone:
NCC(O)C(O)C(N)C(O)COSugarmoiety:
CCCNC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 11 | FractionCSP3: | 1.0 |
| AlogP: | -4.82 | Num_rotatable_bonds: | 11 |
| MolWt: | 383.44 | Num_heavy_atoms: | 26 |
| TPSA: | 203.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD02390
Formula: C6H16O4N2
Smiles:
NCC(O)C(O)C(N)C(O)CO| HBA: | 6 | RingCount: | 0 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | -3.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 180.2 | Num_heavy_atoms: | 12 |
| TPSA: | 132.96 | NumAromaticRings: | 0 |
