Glycoside
GD127021
Name:
[3,4,5-trihydroxy-6-(propan-2-yloxy)oxan-2-yl]methyl 2-ethyl-2,3-dihydroxybutanoateFormula:
C15H28O9Smiles:
CCC(O)(C(=O)OCC1OC(OC(C)C)C(O)C(O)C1O)C(C)OAglycone:
CCC(O)(C(=O)OC)C(C)OSugarmoiety:
CC(C)OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 352.38 | Num_heavy_atoms: | 24 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD51417
Formula: C7H14O4
Smiles:
CCC(O)(C(=O)OC)C(C)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 162.19 | Num_heavy_atoms: | 11 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
