Glycoside
GD119595
Name:
(Z)-4-Coumaric Acid 4-O-Beta-D-Apiofuranosyl-(1-2)-O-Beta-D-Glucopyranosi+Formula:
C20H26O12Smiles:
O=C(O)C=Cc1ccc(OC2OC(CO)C(O)C(O)C2OC2OCC(O)(CO)C2O)cc1Aglycone:
O=C(O)C=Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(OC2OCC(O)(CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.55 |
| AlogP: | -2.57 | Num_rotatable_bonds: | 8 |
| MolWt: | 458.42 | Num_heavy_atoms: | 32 |
| TPSA: | 195.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD00021
Formula: C9H8O3
Smiles:
O=C(O)C=Cc1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 2 |
| MolWt: | 164.16 | Num_heavy_atoms: | 12 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
