Glycoside
GD153279
Name:
Naucleofficine BFormula:
C26H26O9N2Smiles:
CC=C1COC(=O)c2c1cc1n(c2=O)CCc2c-1[nH]c1c(OC3OC(CO)C(O)C(O)C3O)cccc21Aglycone:
CC=C1COC(=O)c2c1cc1n(c2=O)CCc2c-1[nH]c1c(O)cccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 510.5 | Num_heavy_atoms: | 37 |
| TPSA: | 163.47 | NumAromaticRings: | 3 |
Unique Aglycone
AD60975
Formula: C20H16O4N2
Smiles:
CC=C1COC(=O)c2c1cc1n(c2=O)CCc2c-1[nH]c1c(O)cccc21| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 0 |
| MolWt: | 348.36 | Num_heavy_atoms: | 26 |
| TPSA: | 84.32 | NumAromaticRings: | 3 |
