Glycoside
GD152632
Name:
15-methoxy-2,6,14,17-tetramethyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,â·.0¹³,¹â·]heptadec-14-ene-3,11,16-trioneFormula:
C27H38O11Smiles:
COC1=C(C)C2CC(=O)OC3CC4C(C)CC(OC5OC(CO)C(O)C(O)C5O)C(=O)C4(C)C(C1=O)C32CAglycone:
COC1=C(C)C2CC(=O)OC3CC4C(C)CC(O)C(=O)C4(C)C(C1=O)C32CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 538.59 | Num_heavy_atoms: | 38 |
| TPSA: | 169.05 | NumAromaticRings: | 0 |
Unique Aglycone
AD60759
Formula: C21H28O6
Smiles:
COC1=C(C)C2CC(=O)OC3CC4C(C)CC(O)C(=O)C4(C)C(C1=O)C32C| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.76 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 1 |
| MolWt: | 376.45 | Num_heavy_atoms: | 27 |
| TPSA: | 89.9 | NumAromaticRings: | 0 |
