Glycoside
GD139722
Name:
2-{[5-(2,5,5,8a-tetramethyl-decahydronaphthalen-1-yl)-3-methylpent-1-en-3-yl]oxy}oxane-3,4,5-triolFormula:
C25H44O5Smiles:
C=CC(C)(CCC1C(C)CCC2C(C)(C)CCCC12C)OC1OCC(O)C(O)C1OAglycone:
C=CC(C)(O)CCC1C(C)CCC2C(C)(C)CCCC12CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.92 |
| AlogP: | 4.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 424.62 | Num_heavy_atoms: | 30 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD53275
Formula: C20H36O
Smiles:
C=CC(C)(O)CCC1C(C)CCC2C(C)(C)CCCC12C| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.9 |
| AlogP: | 5.58 | Num_rotatable_bonds: | 4 |
| MolWt: | 292.51 | Num_heavy_atoms: | 21 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
