Glycoside
GD147257
Name:
2-[3-(2,4-dihydroxyphenoxy)-4-hydroxyphenyl]-5,7-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4H-chromen-4-oneFormula:
C27H24O13Smiles:
CC1OC(Oc2c(-c3ccc(O)c(Oc4ccc(O)cc4O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1OAglycone:
O=c1c(O)c(-c2ccc(O)c(Oc3ccc(O)cc3O)c2)oc2cc(O)cc(O)c12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.22 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 556.48 | Num_heavy_atoms: | 40 |
| TPSA: | 219.74 | NumAromaticRings: | 4 |
Unique Aglycone
AD58981
Formula: C21H14O9
Smiles:
O=c1c(O)c(-c2ccc(O)c(Oc3ccc(O)cc3O)c2)oc2cc(O)cc(O)c12| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.0 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 410.33 | Num_heavy_atoms: | 30 |
| TPSA: | 160.82 | NumAromaticRings: | 4 |
