Glycoside
GD119881
Name:
18Z-Lyngbyaloside CFormula:
C28H45O10BrSmiles:
COC1C(C)OC(OC2CC3CCC(C)C(O)CC(C)(C=CC=CBr)OC(=O)CC(O)(C2)O3)C(OC)C1OCAglycone:
CC1CCC2CC(O)CC(O)(CC(=O)OC(C)(C=CC=CBr)CC1O)O2Sugarmoiety:
COC1C(C)OC(O)C(OC)C1OCOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.82 |
| AlogP: | 3.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 621.56 | Num_heavy_atoms: | 39 |
| TPSA: | 122.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD48102
Formula: C19H29O6Br
Smiles:
CC1CCC2CC(O)CC(O)(CC(=O)OC(C)(C=CC=CBr)CC1O)O2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.74 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 2 |
| MolWt: | 433.34 | Num_heavy_atoms: | 26 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
