Glycoside
GD147596
Name:
methyl 2-(7-hydroxy-5-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-ylidene)acetateFormula:
C19H22O10Smiles:
COC(=O)C=C1C=C(OC2OC(CO)C(O)C(O)C2O)c2c(C)cc(O)cc2O1Aglycone:
COC(=O)C=C1C=C(O)c2c(C)cc(O)cc2O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.38 | Num_heavy_atoms: | 29 |
| TPSA: | 155.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD59098
Formula: C13H12O5
Smiles:
COC(=O)C=C1C=C(O)c2c(C)cc(O)cc2O1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 1 |
| MolWt: | 248.23 | Num_heavy_atoms: | 18 |
| TPSA: | 75.99 | NumAromaticRings: | 1 |
