Glycoside
GD128933
Name:
2-{[8-formyl-4-(3-hydroxy-3-methylpent-4-en-1-yl)-3,4a,8-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]oxy}-4,5-dihydroxyoxan-3-yl acetateFormula:
C27H42O8Smiles:
C=CC(C)(O)CCC1C(C)=CC(OC2OCC(O)C(O)C2OC(C)=O)C2C(C)(C=O)CCCC12CAglycone:
C=CC(C)(O)CCC1C(C)=CC(O)C2C(C)(C=O)CCCC12CSugarmoiety:
CC(=O)OC1C(O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.78 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 8 |
| MolWt: | 494.63 | Num_heavy_atoms: | 35 |
| TPSA: | 122.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD48496
Formula: C20H32O3
Smiles:
C=CC(C)(O)CCC1C(C)=CC(O)C2C(C)(C=O)CCCC12C| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | 3.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 320.47 | Num_heavy_atoms: | 23 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
