Glycoside
GD126337
Name:
larrealignan bFormula:
C37H54O19Smiles:
COc1cc(CC(C)C(C)Cc2ccc(OC3OC(CO)C(O)C(O)C3O)c(OC3OC(CO)C(O)C(O)C3O)c2)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(CC(C)C(C)Cc2ccc(O)c(O)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 5 |
| HBD: | 12 | FractionCSP3: | 0.68 |
| AlogP: | -3.71 | Num_rotatable_bonds: | 15 |
| MolWt: | 802.82 | Num_heavy_atoms: | 56 |
| TPSA: | 307.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD51109
Formula: C19H24O4
Smiles:
COc1cc(CC(C)C(C)Cc2ccc(O)c(O)c2)ccc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.37 |
| AlogP: | 3.87 | Num_rotatable_bonds: | 6 |
| MolWt: | 316.4 | Num_heavy_atoms: | 23 |
| TPSA: | 69.92 | NumAromaticRings: | 2 |
