Glycoside
GD123501
Name:
7-({3,4-dihydroxy-5-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxolan-3-yl}methoxy)-8-methoxy-3-(4-methoxyphenyl)-4H-chromen-4-oneFormula:
C28H32O14Smiles:
COc1ccc(-c2coc3c(OC)c(OCC4(O)COC(OCC5OC(O)C(O)C(O)C5O)C4O)ccc3c2=O)cc1Aglycone:
COc1ccc(-c2coc3c(OC)c(OC)ccc3c2=O)cc1Sugarmoiety:
OC1OC(COC2OCC(O)(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 9 |
| MolWt: | 592.55 | Num_heavy_atoms: | 42 |
| TPSA: | 206.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD49848
Formula: C18H16O5
Smiles:
COc1ccc(-c2coc3c(OC)c(OC)ccc3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.32 | Num_heavy_atoms: | 23 |
| TPSA: | 57.9 | NumAromaticRings: | 3 |
