Glycoside

GD029300
Name:
NoneFormula:
C31H36O5N2Smiles:
COC[C@@H]1OC(OCc2ccc3ccccc3c2)[C@H](NCCN)C(OCc2cccc3ccccc23)[C@H]1OAglycone:
OCc1ccc2ccccc2c1.OCc1cccc2ccccc12Sugarmoiety:
COCC1OC(O)C(NCCN)C(O)C1OOther Identifiers
Properties
HBA: | 7 | RingCount: | 5 |
HBD: | 4 | FractionCSP3: | 0.35 |
AlogP: | 3.74 | Num_rotatable_bonds: | 11 |
MolWt: | 516.64 | Num_heavy_atoms: | 38 |
TPSA: | 95.2 | NumAromaticRings: | 4 |
Unique Aglycone
AD01045
Formula: C11H10O
Smiles:
OCc1ccc2ccccc2c1HBA: | 1 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.09 |
AlogP: | 2.33 | Num_rotatable_bonds: | 1 |
MolWt: | 158.2 | Num_heavy_atoms: | 12 |
TPSA: | 20.23 | NumAromaticRings: | 2 |
AD04307
Formula: C11H10O
Smiles:
OCc1cccc2ccccc12HBA: | 1 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.09 |
AlogP: | 2.33 | Num_rotatable_bonds: | 1 |
MolWt: | 158.2 | Num_heavy_atoms: | 12 |
TPSA: | 20.23 | NumAromaticRings: | 2 |