Glycoside
GD060365
Name:
NoneFormula:
C17H20O6N2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2ccc3c4c(ccnc24)CCO3)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc2c3c(ccnc13)CCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.36 | Num_heavy_atoms: | 25 |
| TPSA: | 124.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD29812
Formula: C11H10ON2
Smiles:
Nc1ccc2c3c(ccnc13)CCO2| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 0 |
| MolWt: | 186.21 | Num_heavy_atoms: | 14 |
| TPSA: | 48.14 | NumAromaticRings: | 2 |
