Glycoside
GD157064
Name:
2-{[2-(3,4-dihydroxy-5-methoxyphenyl)-4-hydroxy-5,7-dimethoxy-3,4-dihydro-2H-1-benzopyran-3-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C24H30O12Smiles:
COc1cc(OC)c2c(c1)OC(c1cc(O)c(O)c(OC)c1)C(OC1OC(C)C(O)C(O)C1O)C2OAglycone:
COc1cc(OC)c2c(c1)OC(c1cc(O)c(O)c(OC)c1)C(O)C2OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 510.49 | Num_heavy_atoms: | 36 |
| TPSA: | 176.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD62133
Formula: C18H20O8
Smiles:
COc1cc(OC)c2c(c1)OC(c1cc(O)c(O)c(OC)c1)C(O)C2O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 364.35 | Num_heavy_atoms: | 26 |
| TPSA: | 117.84 | NumAromaticRings: | 2 |
