Glycoside
GD114762
Name:
5-ethylidene-8-methoxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,3H,4H,5H,6H,8H-pyrano[3,4-c]pyran-1-oneFormula:
C17H24O10Smiles:
CC=C1C2=C(C(=O)OCC2)C(OC)OC1OC1OC(CO)C(O)C(O)C1OAglycone:
CC=C1C2=C(C(=O)OCC2)C(OC)OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 388.37 | Num_heavy_atoms: | 27 |
| TPSA: | 144.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD45267
Formula: C11H14O5
Smiles:
CC=C1C2=C(C(=O)OCC2)C(OC)OC1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 226.23 | Num_heavy_atoms: | 16 |
| TPSA: | 64.99 | NumAromaticRings: | 0 |
