Glycoside
GD137471
Name:
5-(5-hydroxy-3-methylpentyl)-1,1,4a,6-tetramethyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-1,2,3,4,4a,5,8,8a-octahydronaphthalen-2-yl 2-methylbut-2-enoateFormula:
C30H50O8Smiles:
CC=C(C)C(=O)OC1C(OC2OCC(O)C(O)C2O)CC2(C)C(CCC(C)CCO)C(C)=CCC2C1(C)CAglycone:
CC=C(C)C(=O)OC1C(O)CC2(C)C(CCC(C)CCO)C(C)=CCC2C1(C)CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | 3.51 | Num_rotatable_bonds: | 9 |
| MolWt: | 538.72 | Num_heavy_atoms: | 38 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD49264
Formula: C25H42O4
Smiles:
CC=C(C)C(=O)OC1C(O)CC2(C)C(CCC(C)CCO)C(C)=CCC2C1(C)C| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 5.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 406.61 | Num_heavy_atoms: | 29 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
