Glycoside
GD108133
Name:
NoneFormula:
C30H34O9N6Smiles:
CCCc1nc(C(C)(C)O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1Aglycone:
CCCc1nc(C(C)(C)O)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 11 |
| MolWt: | 622.63 | Num_heavy_atoms: | 45 |
| TPSA: | 226.03 | NumAromaticRings: | 4 |
Unique Aglycone
AD44408
Formula: C24H26O3N6
Smiles:
CCCc1nc(C(C)(C)O)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 3.66 | Num_rotatable_bonds: | 8 |
| MolWt: | 446.51 | Num_heavy_atoms: | 33 |
| TPSA: | 129.81 | NumAromaticRings: | 4 |
