Glycoside
GD157189
Name:
NoneFormula:
C35H37O16Smiles:
CC1OC(OCC2OC(OC3=C(c4ccc(O)c(O)c4)Oc4cc(O)cc5c4C3=CC(c3ccc([OH2+])cc3)O5)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
OC1=C(c2ccc(O)c(O)c2)Oc2cc(O)cc3c2C1=CC(c1ccc([OH2+])cc1)O3Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 7 |
| HBD: | 11 | FractionCSP3: | 0.37 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 713.67 | Num_heavy_atoms: | 51 |
| TPSA: | 260.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD62170
Formula: C23H17O7
Smiles:
OC1=C(c2ccc(O)c(O)c2)Oc2cc(O)cc3c2C1=CC(c1ccc([OH2+])cc1)O3| HBA: | 7 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.04 |
| AlogP: | 4.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 405.38 | Num_heavy_atoms: | 30 |
| TPSA: | 122.28 | NumAromaticRings: | 3 |
