Glycoside
GD025990
Name:
NoneFormula:
C21H22O4N2Smiles:
OC[C@H](O)[C@H](O)[C@H](O)C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12Aglycone:
c1ccc2c(Cc3c[nH]c4ccccc34)c[nH]c2c1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.24 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 366.42 | Num_heavy_atoms: | 27 |
| TPSA: | 112.5 | NumAromaticRings: | 4 |
Unique Aglycone
AD13374
Formula: C17H14N2
Smiles:
c1ccc2c(Cc3c[nH]c4ccccc34)c[nH]c2c1| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 4.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.31 | Num_heavy_atoms: | 19 |
| TPSA: | 31.58 | NumAromaticRings: | 4 |
