Glycoside
GD065916
Name:
NoneFormula:
C14H19O8N3Smiles:
COC(=O)c1cn2c(n1)CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC2Aglycone:
COC(=O)c1cn2c(n1)CNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -3.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 357.32 | Num_heavy_atoms: | 25 |
| TPSA: | 162.42 | NumAromaticRings: | 1 |
Unique Aglycone
AD31690
Formula: C8H11O2N3
Smiles:
COC(=O)c1cn2c(n1)CNCC2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 181.19 | Num_heavy_atoms: | 13 |
| TPSA: | 56.15 | NumAromaticRings: | 1 |
