Glycoside
GD115640
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 2,6,6-trimethylcyclohex-1-ene-1-carboxylateFormula:
C16H26O7Smiles:
CC1=C(C(=O)OC2OC(CO)C(O)C(O)C2O)C(C)(C)CCC1Aglycone:
CC1=C(C(=O)O)C(C)(C)CCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.38 | Num_heavy_atoms: | 23 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD19885
Formula: C10H16O2
Smiles:
CC1=C(C(=O)O)C(C)(C)CCC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | 2.6 | Num_rotatable_bonds: | 1 |
| MolWt: | 168.24 | Num_heavy_atoms: | 12 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
