Glycoside
GD119197
Name:
2-cyano-2-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethylidene)ethyl 3-(4-hydroxyphenyl)prop-2-enoateFormula:
C20H23O9NSmiles:
N#CC(=CCOC1OC(CO)C(O)C(O)C1O)COC(=O)C=Cc1ccc(O)cc1Aglycone:
N#CC(=CCO)COC(=O)C=Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 8 |
| MolWt: | 421.4 | Num_heavy_atoms: | 30 |
| TPSA: | 169.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD47715
Formula: C14H13O4N
Smiles:
N#CC(=CCO)COC(=O)C=Cc1ccc(O)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 259.26 | Num_heavy_atoms: | 19 |
| TPSA: | 90.55 | NumAromaticRings: | 1 |
