Glycoside
GD129007
Name:
FumotonaringinFormula:
C28H34O14Smiles:
COC1C(CO)OC(Oc2cc(O)c3c(c2)OC(c2ccc(O)cc2)CC3=O)C(OC2OC(C)C(O)C(O)C2O)C1OAglycone:
O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21Sugarmoiety:
COC1C(CO)OC(O)C(OC2OC(C)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 7 |
| MolWt: | 594.57 | Num_heavy_atoms: | 42 |
| TPSA: | 214.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD03294
Formula: C15H12O5
Smiles:
O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
