Glycoside
GD023595
Name:
2-(3,5-dihydroxy-4-methoxyphenyl)-7-hydroxy-5-methoxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C23H26O12Smiles:
COc1cc(O)cc2c1C(=O)[C@H](O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O)[C@H](c1cc(O)c(OC)c(O)c1)O2Aglycone:
COc1cc(O)cc2c1C(=O)C(O)C(c1cc(O)c(OC)c(O)c1)O2Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 494.45 | Num_heavy_atoms: | 35 |
| TPSA: | 184.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD15854
Formula: C17H16O8
Smiles:
COc1cc(O)cc2c1C(=O)C(O)C(c1cc(O)c(OC)c(O)c1)O2| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.31 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
