Glycoside
GD131871
Name:
4-(2-nitroethyl)phenyl primeverosideFormula:
C19H29O12NSmiles:
[O-][NH+](O)CCc1ccc(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)cc1Aglycone:
[O-][NH+](O)CCc1ccc(O)cc1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.68 |
| AlogP: | -4.36 | Num_rotatable_bonds: | 8 |
| MolWt: | 463.44 | Num_heavy_atoms: | 32 |
| TPSA: | 206.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD44971
Formula: C8H11O3N
Smiles:
[O-][NH+](O)CCc1ccc(O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 169.18 | Num_heavy_atoms: | 12 |
| TPSA: | 67.96 | NumAromaticRings: | 1 |
