Glycoside
GD126000
Name:
Marmesin; (S)-Form, O-α-L-RhamnopyranosideFormula:
C20H24O8Smiles:
CC1OC(OC(C)(C)C2Cc3cc4ccc(=O)oc4cc3O2)C(O)C(O)C1OAglycone:
CC(C)(O)C1Cc2cc3ccc(=O)oc3cc2O1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 392.4 | Num_heavy_atoms: | 28 |
| TPSA: | 118.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD03997
Formula: C14H14O4
Smiles:
CC(C)(O)C1Cc2cc3ccc(=O)oc3cc2O1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 246.26 | Num_heavy_atoms: | 18 |
| TPSA: | 59.67 | NumAromaticRings: | 2 |
