Glycoside
GD122621
Name:
Oxopropaline EFormula:
C21H24O6N2Smiles:
Cc1cnc(C(=O)CCOC2OC(C)C(O)C(O)C2O)c2[nH]c3ccccc3c12Aglycone:
Cc1cnc(C(=O)CCO)c2[nH]c3ccccc3c12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.43 | Num_heavy_atoms: | 29 |
| TPSA: | 124.9 | NumAromaticRings: | 3 |
Unique Aglycone
AD49430
Formula: C15H14O2N2
Smiles:
Cc1cnc(C(=O)CCO)c2[nH]c3ccccc3c12| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 254.29 | Num_heavy_atoms: | 19 |
| TPSA: | 65.98 | NumAromaticRings: | 3 |
