Glycoside
GD145347
Name:
methyl 3-ethylidene-4-propyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylateFormula:
C18H28O9Smiles:
CC=C1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CCCAglycone:
CC=C1C(O)OC=C(C(=O)OC)C1CCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 388.41 | Num_heavy_atoms: | 27 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD58354
Formula: C12H18O4
Smiles:
CC=C1C(O)OC=C(C(=O)OC)C1CCC| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 226.27 | Num_heavy_atoms: | 16 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
