Glycoside
GD121863
Name:
2-(4-{15,16-dihydroxy-6-methoxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,â¹.0â´,â¸.0¹³,¹â¸]icosan-6-yl}-2-methylbutoxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C34H58O10Smiles:
COC1(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC2CC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C2C1CAglycone:
COC1(CCC(C)CO)OC2CC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C2C1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 2.2 | Num_rotatable_bonds: | 8 |
| MolWt: | 626.83 | Num_heavy_atoms: | 44 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD05189
Formula: C28H48O5
Smiles:
COC1(CCC(C)CO)OC2CC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C2C1C| HBA: | 5 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 4.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 464.69 | Num_heavy_atoms: | 33 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
