Glycoside
GD156945
Name:
Spiraformin DFormula:
C24H26O11Smiles:
O=C(O)C=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)c(Oc2ccc(CCC(=O)O)cc2)c1Aglycone:
O=C(O)C=Cc1ccc(O)c(Oc2ccc(CCC(=O)O)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 10 |
| MolWt: | 490.46 | Num_heavy_atoms: | 35 |
| TPSA: | 183.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD62096
Formula: C18H16O6
Smiles:
O=C(O)C=Cc1ccc(O)c(Oc2ccc(CCC(=O)O)cc2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 328.32 | Num_heavy_atoms: | 24 |
| TPSA: | 104.06 | NumAromaticRings: | 2 |
