Glycoside
GD125796
Name:
Marmin; (R)-Form, 4'R-Hydroxy, 6'-O-β-D-GlucopyranosideFormula:
C25H34O11Smiles:
CC(=CCOc1ccc2ccc(=O)oc2c1)C(O)CC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)OAglycone:
CC(=CCOc1ccc2ccc(=O)oc2c1)C(O)CC(O)C(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 10 |
| MolWt: | 510.54 | Num_heavy_atoms: | 36 |
| TPSA: | 179.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD50883
Formula: C19H24O6
Smiles:
CC(=CCOc1ccc2ccc(=O)oc2c1)C(O)CC(O)C(C)(C)O| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 7 |
| MolWt: | 348.4 | Num_heavy_atoms: | 25 |
| TPSA: | 100.13 | NumAromaticRings: | 2 |
