Glycoside
GD127774
Name:
1-[3-(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)propan-1-oneFormula:
C26H32O13Smiles:
O=C(CCc1ccc(O)cc1)c1ccc(O)c(C2OC(CO)C(O)C(O)C2OC2OCC(O)(CO)C2O)c1OAglycone:
O=C(CCc1ccc(O)cc1)c1ccc(O)cc1OSugarmoiety:
OCC1OC(O)C(OC2OCC(O)(CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.5 |
| AlogP: | -1.4 | Num_rotatable_bonds: | 9 |
| MolWt: | 552.53 | Num_heavy_atoms: | 39 |
| TPSA: | 226.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD05271
Formula: C15H14O4
Smiles:
O=C(CCc1ccc(O)cc1)c1ccc(O)cc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 258.27 | Num_heavy_atoms: | 19 |
| TPSA: | 77.76 | NumAromaticRings: | 2 |
