Glycoside
GD004767
Name:
NoneFormula:
C23H26O7N2Smiles:
OC[C@@H]1O[C@H](Oc2cccc3ncn(CCc4ccc5c(c4)CCO5)c23)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1cccc2ncn(CCc3ccc4c(c3)CCO4)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 442.47 | Num_heavy_atoms: | 32 |
| TPSA: | 126.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD04121
Formula: C17H16O2N2
Smiles:
Oc1cccc2ncn(CCc3ccc4c(c3)CCO4)c12| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 3 |
| MolWt: | 280.33 | Num_heavy_atoms: | 21 |
| TPSA: | 47.28 | NumAromaticRings: | 3 |
