Glycoside
GD141529
Name:
NoneFormula:
C30H28O13Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1=Cc2c(OC3OC(CO)C(O)C(O)C3O)cc(O)cc2[OH+]C1=C1C=C[C](O)C=C1Aglycone:
O=C(C=Cc1ccc(O)c(O)c1)OC1=Cc2c(O)cc(O)cc2[OH+]C1=C1C=CC(O)C=C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.2 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 596.54 | Num_heavy_atoms: | 43 |
| TPSA: | 219.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD57006
Formula: C24H19O8
Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1=Cc2c(O)cc(O)cc2[OH+]C1=C1C=CC(O)C=C1| HBA: | 8 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.04 |
| AlogP: | 3.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 435.41 | Num_heavy_atoms: | 32 |
| TPSA: | 140.25 | NumAromaticRings: | 2 |
