Glycoside
GD120365
Name:
2-{[1-hydroxy-3,8-dimethyl-5-(6-methylhept-5-en-2-yl)-5,6,7,8-tetrahydronaphthalen-2-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C26H40O6Smiles:
CC(C)=CCCC(C)C1CCC(C)c2c1cc(C)c(OC1OC(C)C(O)C(O)C1O)c2OAglycone:
CC(C)=CCCC(C)C1CCC(C)c2c1cc(C)c(O)c2OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | 4.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 448.6 | Num_heavy_atoms: | 32 |
| TPSA: | 99.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD02046
Formula: C20H30O2
Smiles:
CC(C)=CCCC(C)C1CCC(C)c2c1cc(C)c(O)c2O| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 5.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 302.46 | Num_heavy_atoms: | 22 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
