Glycoside
GD117657
Name:
14-ethoxy-7,10-dimethyl-4-(propan-2-yl)-11-[(3,4,5-trihydroxyoxan-2-yl)oxy]-3-oxatetracyclo[8.5.0.0²,â´.0²,â·]pentadec-12-ene-13-carbaldehydeFormula:
C27H42O8Smiles:
CCOC1CC2C(C)(CCC3(C)CCC4(C(C)C)OC234)C(OC2OCC(O)C(O)C2O)C=C1C=OAglycone:
CCOC1CC2C(C)(CCC3(C)CCC4(C(C)C)OC234)C(O)C=C1C=OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.89 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.63 | Num_heavy_atoms: | 35 |
| TPSA: | 117.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD46944
Formula: C22H34O4
Smiles:
CCOC1CC2C(C)(CCC3(C)CCC4(C(C)C)OC234)C(O)C=C1C=O| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 3.66 | Num_rotatable_bonds: | 4 |
| MolWt: | 362.51 | Num_heavy_atoms: | 26 |
| TPSA: | 59.06 | NumAromaticRings: | 0 |
