Glycoside
GD157582
Name:
2-(hydroxymethyl)-6-({10-methoxy-2,2-dimethyl-2H,3H,4H,8H-pyrano[3,2-g]chromen-3-yl}oxy)oxane-3,4,5-triolFormula:
C21H28O9Smiles:
COc1c2c(cc3c1OC(C)(C)C(OC1OC(CO)C(O)C(O)C1O)C3)C=CCO2Aglycone:
COc1c2c(cc3c1OC(C)(C)C(O)C3)C=CCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 424.45 | Num_heavy_atoms: | 30 |
| TPSA: | 127.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD62291
Formula: C15H18O4
Smiles:
COc1c2c(cc3c1OC(C)(C)C(O)C3)C=CCO2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 262.3 | Num_heavy_atoms: | 19 |
| TPSA: | 47.92 | NumAromaticRings: | 1 |
