Glycoside
GD083078
Name:
2-(2-hydroxypropan-2-yl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,3H,7H-furo[3,2-g]chromen-7-oneFormula:
C20H24O10Smiles:
CC(C)(O)[C@@H]1Oc2cc3oc(=O)ccc3cc2[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OAglycone:
CC(C)(O)C1Oc2cc3oc(=O)ccc3cc2C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 4 |
| MolWt: | 424.4 | Num_heavy_atoms: | 30 |
| TPSA: | 159.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD37149
Formula: C14H14O5
Smiles:
CC(C)(O)C1Oc2cc3oc(=O)ccc3cc2C1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 1 |
| MolWt: | 262.26 | Num_heavy_atoms: | 19 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
