Glycoside
GD140472
Name:
2-(4-hydroxyphenyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4,5,7-triolFormula:
C21H24O11Smiles:
OCC1OC(OC2C(O)c3c(O)cc(O)cc3OC2c2ccc(O)cc2)C(O)C(O)C1OAglycone:
Oc1ccc(C2Oc3cc(O)cc(O)c3C(O)C2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.43 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 452.41 | Num_heavy_atoms: | 32 |
| TPSA: | 189.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD55336
Formula: C15H14O6
Smiles:
Oc1ccc(C2Oc3cc(O)cc(O)c3C(O)C2O)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.2 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 290.27 | Num_heavy_atoms: | 21 |
| TPSA: | 110.38 | NumAromaticRings: | 2 |
