Glycoside
GD128544
Name:
9-[(3-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-2-en-1-yl)oxy]-7H-furo[3,2-g]chromen-7-oneFormula:
C22H24O10Smiles:
CC(=CCOc1c2occc2cc2ccc(=O)oc12)COC1OC(CO)C(O)C(O)C1OAglycone:
CC(=CCOc1c2occc2cc2ccc(=O)oc12)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 7 |
| MolWt: | 448.42 | Num_heavy_atoms: | 32 |
| TPSA: | 151.96 | NumAromaticRings: | 3 |
Unique Aglycone
AD52068
Formula: C16H14O5
Smiles:
CC(=CCOc1c2occc2cc2ccc(=O)oc12)CO| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 286.28 | Num_heavy_atoms: | 21 |
| TPSA: | 72.81 | NumAromaticRings: | 3 |
