Glycoside
GD135908
Name:
10-(2-hydroxyethyl)-2,8,8-trimethyl-7-[(2,3,4,5,6-pentahydroxyhexyl)peroxy]-4H,6H,7H,8H-pyrano[3,2-g]chromen-4-oneFormula:
C23H32O11Smiles:
Cc1cc(=O)c2cc3c(c(CCO)c2o1)OC(C)(C)C(OOCC(O)C(O)C(O)C(O)CO)C3Aglycone:
Cc1cc(=O)c2cc3c(c(CCO)c2o1)OC(C)(C)C(O)C3Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 10 |
| MolWt: | 484.5 | Num_heavy_atoms: | 34 |
| TPSA: | 179.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD50081
Formula: C17H20O5
Smiles:
Cc1cc(=O)c2cc3c(c(CCO)c2o1)OC(C)(C)C(O)C3| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 304.34 | Num_heavy_atoms: | 22 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
