Glycoside
GD142024
Name:
2-{[6-hydroxy-4-(3-hydroxybut-1-en-1-yl)-3,5,5-trimethylcyclohex-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H32O8Smiles:
CC1=CC(OC2OC(CO)C(O)C(O)C2O)C(O)C(C)(C)C1C=CC(C)OAglycone:
CC1=CC(O)C(O)C(C)(C)C1C=CC(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.79 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.46 | Num_heavy_atoms: | 27 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD57175
Formula: C13H22O3
Smiles:
CC1=CC(O)C(O)C(C)(C)C1C=CC(C)O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.69 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 226.32 | Num_heavy_atoms: | 16 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
