Glycoside
GD134202
Name:
8-cyclohexyl-2,8-dimethyl-7-[(2,3,4,5,6-pentahydroxyhexyl)peroxy]-4H,6H,7H,8H-pyrano[3,2-g]chromen-4-oneFormula:
C26H36O10Smiles:
Cc1cc(=O)c2cc3c(cc2o1)OC(C)(C1CCCCC1)C(OOCC(O)C(O)C(O)C(O)CO)C3Aglycone:
Cc1cc(=O)c2cc3c(cc2o1)OC(C)(C1CCCCC1)C(O)C3Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 9 |
| MolWt: | 508.56 | Num_heavy_atoms: | 36 |
| TPSA: | 159.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD51177
Formula: C20H24O4
Smiles:
Cc1cc(=O)c2cc3c(cc2o1)OC(C)(C1CCCCC1)C(O)C3| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 3.74 | Num_rotatable_bonds: | 1 |
| MolWt: | 328.41 | Num_heavy_atoms: | 24 |
| TPSA: | 59.67 | NumAromaticRings: | 2 |
