Glycoside
GD155877
Name:
5-hydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1,4-benzoxazin-3-oneFormula:
C14H17O9NSmiles:
OCC1OC(OC2Oc3cccc(O)c3N=C2O)C(O)C(O)C1OAglycone:
OC1=Nc2c(O)cccc2OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 343.29 | Num_heavy_atoms: | 24 |
| TPSA: | 161.43 | NumAromaticRings: | 1 |
Unique Aglycone
AD61777
Formula: C8H7O4N
Smiles:
OC1=Nc2c(O)cccc2OC1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 0 |
| MolWt: | 181.15 | Num_heavy_atoms: | 13 |
| TPSA: | 82.28 | NumAromaticRings: | 1 |
