Glycoside
GD122268
Name:
3-(3,4-dihydroxyphenyl)-3-hydroxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-1-(2,4,6-trihydroxyphenyl)propan-1-oneFormula:
C21H24O12Smiles:
CC1OC(OC(C(=O)c2c(O)cc(O)cc2O)C(O)c2ccc(O)c(O)c2)C(O)C(O)C1OAglycone:
O=C(c1c(O)cc(O)cc1O)C(O)C(O)c1ccc(O)c(O)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.38 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 6 |
| MolWt: | 468.41 | Num_heavy_atoms: | 33 |
| TPSA: | 217.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD49254
Formula: C15H14O8
Smiles:
O=C(c1c(O)cc(O)cc1O)C(O)C(O)c1ccc(O)c(O)c1| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.13 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 322.27 | Num_heavy_atoms: | 23 |
| TPSA: | 158.68 | NumAromaticRings: | 2 |
