Glycoside
GD136883
Name:
ophiorine b methyl esterFormula:
C27H33O9N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC2C(C(=O)OC)C1CC1=C3[NH2+]c4ccccc4C3=CCN12Aglycone:
C=CC1C(O)OC2C(C(=O)OC)C1CC1=C3[NH2+]c4ccccc4C3=CCN12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 529.57 | Num_heavy_atoms: | 38 |
| TPSA: | 154.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD55324
Formula: C21H23O4N2
Smiles:
C=CC1C(O)OC2C(C(=O)OC)C1CC1=C3[NH2+]c4ccccc4C3=CCN12| HBA: | 6 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 2 |
| MolWt: | 367.43 | Num_heavy_atoms: | 27 |
| TPSA: | 75.61 | NumAromaticRings: | 1 |
