Glycoside
GD121691
Name:
2-phenyl-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-4H-chromen-4-oneFormula:
C27H30O12Smiles:
CC1OC(OCC2OC(Oc3c(-c4ccccc4)oc4ccccc4c3=O)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
O=c1c(O)c(-c2ccccc2)oc2ccccc12Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 546.53 | Num_heavy_atoms: | 39 |
| TPSA: | 188.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD17825
Formula: C15H10O3
Smiles:
O=c1c(O)c(-c2ccccc2)oc2ccccc12| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.17 | Num_rotatable_bonds: | 1 |
| MolWt: | 238.24 | Num_heavy_atoms: | 18 |
| TPSA: | 50.44 | NumAromaticRings: | 3 |
