Glycoside
GD002484
Name:
SECO-PSEUDOPTEROSIN AFormula:
C25H38O6Smiles:
CC(C)=CCC[C@H](C)[C@@H]1CC[C@H](C)c2c1cc(C)c(O)c2O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1OAglycone:
CC(C)=CCCC(C)C1CCC(C)c2c1cc(C)c(O)c2OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.68 |
| AlogP: | 3.88 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.57 | Num_heavy_atoms: | 31 |
| 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 |
