Glycoside
GD138480
Name:
Glabraoside AFormula:
C30H30O13Smiles:
CC1OC(OC2Cc3c(O)cc4c(c3OC2c2ccc(O)c(O)c2)C(c2ccc(O)c(O)c2)CC(=O)O4)C(O)C(O)C1OAglycone:
O=C1CC(c2ccc(O)c(O)c2)c2c(cc(O)c3c2OC(c2ccc(O)c(O)c2)C(O)C3)O1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.37 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 598.56 | Num_heavy_atoms: | 43 |
| TPSA: | 215.83 | NumAromaticRings: | 3 |
Unique Aglycone
AD55892
Formula: C24H20O9
Smiles:
O=C1CC(c2ccc(O)c(O)c2)c2c(cc(O)c3c2OC(c2ccc(O)c(O)c2)C(O)C3)O1| HBA: | 9 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.21 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 452.42 | Num_heavy_atoms: | 33 |
| TPSA: | 156.91 | NumAromaticRings: | 3 |
