Glycoside
GD147906
Name:
4-hydroxy-3-methyl-5-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H,3H-naphtho[2,3-c]furan-1-oneFormula:
C25H30O14Smiles:
CC1OC(=O)c2cc3cccc(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)c3c(O)c21Aglycone:
CC1OC(=O)c2cc3cccc(O)c3c(O)c21Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.56 |
| AlogP: | -2.22 | Num_rotatable_bonds: | 6 |
| MolWt: | 554.5 | Num_heavy_atoms: | 39 |
| TPSA: | 225.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD59213
Formula: C13H10O4
Smiles:
CC1OC(=O)c2cc3cccc(O)c3c(O)c21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 0 |
| MolWt: | 230.22 | Num_heavy_atoms: | 17 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
