Glycoside
GD124974
Name:
Dipsanoside GFormula:
C29H44O15Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC2CC3C(COC(O)C3C(=O)OC)C2C)C1CC(OC)OCAglycone:
C=CC1C(O)OC=C(C(=O)OC2CC3C(COC(O)C3C(=O)OC)C2C)C1CC(OC)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 11 |
| MolWt: | 632.66 | Num_heavy_atoms: | 44 |
| TPSA: | 209.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD50534
Formula: C23H34O10
Smiles:
C=CC1C(O)OC=C(C(=O)OC2CC3C(COC(O)C3C(=O)OC)C2C)C1CC(OC)OC| HBA: | 10 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.74 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 8 |
| MolWt: | 470.52 | Num_heavy_atoms: | 33 |
| TPSA: | 129.98 | NumAromaticRings: | 0 |
