Glycoside
GD008621
Name:
NoneFormula:
C50H49O6N7Smiles:
Nc1ccc(C2c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc([nH]3)C(c3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3)c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc2[nH]3)cc1Aglycone:
Nc1ccc(C2c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc([nH]3)C(c3ccc(O)cc3)c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc2[nH]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 10 |
| HBD: | 14 | FractionCSP3: | 0.2 |
| AlogP: | 5.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 843.99 | Num_heavy_atoms: | 63 |
| TPSA: | 240.6 | NumAromaticRings: | 8 |
Unique Aglycone
AD06862
Formula: C44H39ON7
Smiles:
Nc1ccc(C2c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc([nH]3)C(c3ccc(O)cc3)c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc2[nH]3)cc1| HBA: | 8 | RingCount: | 9 |
| HBD: | 11 | FractionCSP3: | 0.09 |
| AlogP: | 8.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 681.84 | Num_heavy_atoms: | 52 |
| TPSA: | 161.45 | NumAromaticRings: | 8 |
