Glycoside
GD027469
Name:
SOPHENAZINE EFormula:
C20H20O7N2Smiles:
COC(=O)c1cccc2nc3c(O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)cccc3nc12Aglycone:
COC(=O)c1cccc2nc3c(O)cccc3nc12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 400.39 | Num_heavy_atoms: | 29 |
| TPSA: | 131.23 | NumAromaticRings: | 3 |
Unique Aglycone
AD18053
Formula: C14H10O3N2
Smiles:
COC(=O)c1cccc2nc3c(O)cccc3nc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 254.24 | Num_heavy_atoms: | 19 |
| TPSA: | 72.31 | NumAromaticRings: | 3 |
