Glycoside
GD145548
Name:
Bracteatin 6-O-Beta-GlucosideFormula:
C21H20O12Smiles:
O=C1C(=Cc2cc(O)c(O)c(O)c2)Oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c21Aglycone:
O=C1C(=Cc2cc(O)c(O)c(O)c2)Oc2cc(O)cc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.29 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 464.38 | Num_heavy_atoms: | 33 |
| TPSA: | 206.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD13923
Formula: C15H10O7
Smiles:
O=C1C(=Cc2cc(O)c(O)c(O)c2)Oc2cc(O)cc(O)c21| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.24 | Num_heavy_atoms: | 22 |
| TPSA: | 127.45 | NumAromaticRings: | 2 |
