Glycoside
GD144834
Name:
3,7-dihydroxy-5-methoxy-8-(3,4,5-trihydroxy-6-methyloxan-2-yl)-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-oneFormula:
C22H22O12Smiles:
COc1cc(O)c(C2OC(C)C(O)C(O)C2O)c2oc(-c3cc(O)c(O)c(O)c3)c(O)c(=O)c12Aglycone:
COc1cc(O)cc2oc(-c3cc(O)c(O)c(O)c3)c(O)c(=O)c12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.32 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 3 |
| MolWt: | 478.41 | Num_heavy_atoms: | 34 |
| TPSA: | 210.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD45043
Formula: C16H12O8
Smiles:
COc1cc(O)cc2oc(-c3cc(O)c(O)c(O)c3)c(O)c(=O)c12| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.06 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 2 |
| MolWt: | 332.26 | Num_heavy_atoms: | 24 |
| TPSA: | 140.59 | NumAromaticRings: | 3 |
