Glycoside
GD016739
Name:
NoneFormula:
C32H36O9N4Smiles:
COc1ccccc1Cc1cc(-c2ccc(C)cc2)n[nH]c1=NN=CC(OC(C)=O)C(OC(C)=O)C(COC(C)=O)OC(C)=OAglycone:
C=NN=c1[nH]nc(-c2ccc(C)cc2)cc1Cc1ccccc1OCSugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(O)OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.34 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 13 |
| MolWt: | 620.66 | Num_heavy_atoms: | 45 |
| TPSA: | 167.83 | NumAromaticRings: | 3 |
Unique Aglycone
AD12014
Formula: C20H20ON4
Smiles:
C=NN=c1[nH]nc(-c2ccc(C)cc2)cc1Cc1ccccc1OC| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 3.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 332.41 | Num_heavy_atoms: | 25 |
| TPSA: | 62.63 | NumAromaticRings: | 3 |
