Glycoside
GD065791
Name:
NoneFormula:
C15H18O8N2Smiles:
COC(=O)/C=C/c1ccc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)nc1Aglycone:
COC(=O)C=Cc1ccc(N)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 8 |
| MolWt: | 354.32 | Num_heavy_atoms: | 25 |
| TPSA: | 166.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD31650
Formula: C9H10O2N2
Smiles:
COC(=O)C=Cc1ccc(N)nc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 178.19 | Num_heavy_atoms: | 13 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
