Glycoside
GD140266
Name:
2-{[4-(1,4-dihydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H34O8Smiles:
CC1=CC(O)CC(C)(C)C1(O)CCC(C)OC1OC(CO)C(O)C(O)C1OAglycone:
CC1=CC(O)CC(C)(C)C1(O)CCC(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.89 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 390.47 | Num_heavy_atoms: | 27 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD52766
Formula: C13H24O3
Smiles:
CC1=CC(O)CC(C)(C)C1(O)CCC(C)O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.85 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 228.33 | Num_heavy_atoms: | 16 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
