Glycoside
GD029180
Name:
Caffeoyl 6-O-β-D-GlucopyranosideFormula:
C15H18O9Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)C=Cc1ccc(O)c(O)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -1.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 342.3 | Num_heavy_atoms: | 24 |
| TPSA: | 156.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD03431
Formula: C10H10O4
Smiles:
COC(=O)C=Cc1ccc(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 194.19 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
