Glycoside
GD148788
Name:
2-({6-[(3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl)oxy]-4,5-dihydroxyoxan-3-yl}oxy)oxane-3,4,5-triolFormula:
C45H74O9Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOC1OCC(OC2OCC(O)C(O)C2O)C(O)C1OAglycone:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOSugarmoiety:
OC1COC(OC2COC(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | 8.23 | Num_rotatable_bonds: | 23 |
| MolWt: | 759.08 | Num_heavy_atoms: | 54 |
| TPSA: | 138.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD46113
Formula: C35H58O
Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 11.3 | Num_rotatable_bonds: | 19 |
| MolWt: | 494.85 | Num_heavy_atoms: | 36 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
