Glycoside
GD150187
Name:
7-chloro-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1,4-benzoxazin-3-oneFormula:
C15H16O8NClSmiles:
OCC1OC(OC2Oc3cc(Cl)ccc3N=C2O)C(O)C(O)C1OAglycone:
OC1=Nc2ccc(Cl)cc2OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 3 |
| MolWt: | 361.73 | Num_heavy_atoms: | 24 |
| TPSA: | 141.2 | NumAromaticRings: | 1 |
Unique Aglycone
AD60007
Formula: C9H6O3NCl
Smiles:
OC1=Nc2ccc(Cl)cc2OC1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 0 |
| MolWt: | 199.59 | Num_heavy_atoms: | 13 |
| TPSA: | 62.05 | NumAromaticRings: | 1 |
