Glycoside
GD034647
Name:
NoneFormula:
C14H20O8N2Smiles:
Cc1nc(CO[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)c(C)nc1COAglycone:
Cc1nc(CO)c(C)nc1COSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 344.32 | Num_heavy_atoms: | 24 |
| TPSA: | 162.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD21998
Formula: C8H12O2N2
Smiles:
Cc1nc(CO)c(C)nc1CO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 168.2 | Num_heavy_atoms: | 12 |
| TPSA: | 66.24 | NumAromaticRings: | 1 |
