Glycoside
GD150010
Name:
7,8-dimethoxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1,4-benzoxazin-3-oneFormula:
C16H21O10NSmiles:
COc1ccc2c(c1OC)OC(OC1OC(CO)C(O)C(O)C1O)C(O)=N2Aglycone:
COc1ccc2c(c1OC)OC(O)C(O)=N2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 387.34 | Num_heavy_atoms: | 27 |
| TPSA: | 159.66 | NumAromaticRings: | 1 |
Unique Aglycone
AD59951
Formula: C10H11O5N
Smiles:
COc1ccc2c(c1OC)OC(O)C(O)=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 2 |
| MolWt: | 225.2 | Num_heavy_atoms: | 16 |
| TPSA: | 80.51 | NumAromaticRings: | 1 |
