Glycoside
GD127766
Name:
NoneFormula:
C23H27O13Smiles:
COc1cc(C2Oc3cc(O)cc(OC)c3C(=O)C2OC2OC(C[OH2+])C(O)C(O)C2O)cc(O)c1OAglycone:
COc1cc(C2Oc3cc(O)cc(OC)c3C(=O)C2O)cc(O)c1OSugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.43 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 6 |
| MolWt: | 511.46 | Num_heavy_atoms: | 36 |
| TPSA: | 207.5 | NumAromaticRings: | 2 |
Unique Aglycone
AD51749
Formula: C17H16O8
Smiles:
COc1cc(C2Oc3cc(O)cc(OC)c3C(=O)C2O)cc(O)c1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.31 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
