Glycoside
GD140294
Name:
3,5,7-trihydroxy-2-{4-hydroxy-3-[(3,4,5,6-tetrahydroxyoxan-2-yl)oxy]phenyl}-4H-chromen-4-oneFormula:
C20H18O12Smiles:
O=c1c(O)c(-c2ccc(O)c(OC3OC(O)C(O)C(O)C3O)c2)oc2cc(O)cc(O)c12Aglycone:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.25 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 450.35 | Num_heavy_atoms: | 32 |
| TPSA: | 210.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD00377
Formula: C15H10O7
Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.24 | Num_heavy_atoms: | 22 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
