Glycoside
GD153708
Name:
5,7-dihydroxy-8-[5-(5-hydroxy-4-oxo-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-2-yl)-2-methoxyphenyl]-2-(4-methoxyphenyl)-4H-chromen-4-oneFormula:
C38H32O15Smiles:
COc1ccc(-c2cc(=O)c3c(O)cc(O)c(-c4cc(-c5cc(=O)c6c(O)cc(OC7OC(CO)C(O)C(O)C7O)cc6o5)ccc4OC)c3o2)cc1Aglycone:
COc1ccc(-c2cc(=O)c3c(O)cc(O)c(-c4cc(-c5cc(=O)c6c(O)cc(O)cc6o5)ccc4OC)c3o2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.21 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 8 |
| MolWt: | 728.66 | Num_heavy_atoms: | 53 |
| TPSA: | 238.95 | NumAromaticRings: | 6 |
Unique Aglycone
AD61101
Formula: C32H22O10
Smiles:
COc1ccc(-c2cc(=O)c3c(O)cc(O)c(-c4cc(-c5cc(=O)c6c(O)cc(O)cc6o5)ccc4OC)c3o2)cc1| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.06 |
| AlogP: | 5.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 566.52 | Num_heavy_atoms: | 42 |
| TPSA: | 159.8 | NumAromaticRings: | 6 |
