Glycoside
GD125297
Name:
5-hydroxy-2,8,8-trimethyl-7-[(2,3,4,5,6-pentahydroxyhexyl)peroxy]-4H,6H,7H,8H-pyrano[3,2-g]chromen-4-oneFormula:
C21H28O11Smiles:
Cc1cc(=O)c2c(O)c3c(cc2o1)OC(C)(C)C(OOCC(O)C(O)C(O)C(O)CO)C3Aglycone:
Cc1cc(=O)c2c(O)c3c(cc2o1)OC(C)(C)C(O)C3Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 8 |
| MolWt: | 456.44 | Num_heavy_atoms: | 32 |
| TPSA: | 179.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD07484
Formula: C15H16O5
Smiles:
Cc1cc(=O)c2c(O)c3c(cc2o1)OC(C)(C)C(O)C3| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 0 |
| MolWt: | 276.29 | Num_heavy_atoms: | 20 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
