Glycoside
GD129343
Name:
2-methyl-6-[(3,4,5-trihydroxy-6-{[4-hydroxy-3-(propan-2-yl)pentyl]oxy}oxan-2-yl)methoxy]oxane-3,4,5-triolFormula:
C20H38O11Smiles:
CC(C)C(CCOC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O)C(C)OAglycone:
CC(C)C(CCO)C(C)OSugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 9 |
| MolWt: | 454.51 | Num_heavy_atoms: | 31 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD52402
Formula: C8H18O2
Smiles:
CC(C)C(CCO)C(C)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 146.23 | Num_heavy_atoms: | 10 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
