Glycoside
GD153378
Name:
6-({2-[(2-{[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]methyl}-3,5,6-trihydroxyoxan-4-yl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C24H38O23Smiles:
O=C(O)C1OC(OCC2OC(O)C(O)C(OC3OC(CO)C(O)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3O)C2O)C(O)C(O)C1OAglycone:
[empty]Sugarmoiety:
O=C(O)C1OC(OCC2OC(O)C(O)C(OC3OC(CO)C(O)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 23 | RingCount: | 4 |
| HBD: | 14 | FractionCSP3: | 0.92 |
| AlogP: | -9.56 | Num_rotatable_bonds: | 10 |
| MolWt: | 694.55 | Num_heavy_atoms: | 47 |
| TPSA: | 381.97 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD10112
O=C(O)C1OC(OCC2OC(O)C(O)C(OC3OC(CO)C(O)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3O)C2O)C(O)C(O)C1O