Glycoside
GD034318
Name:
Glycyphyllin BFormula:
C21H24O10Smiles:
C[C@@H]1O[C@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C(CCc1ccc(O)c(O)c1)c1c(O)cc(O)cc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.41 | Num_heavy_atoms: | 31 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD20902
Formula: C15H14O6
Smiles:
O=C(CCc1ccc(O)c(O)c1)c1c(O)cc(O)cc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.13 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 290.27 | Num_heavy_atoms: | 21 |
| TPSA: | 118.22 | NumAromaticRings: | 2 |
