Glycoside
GD137390
Name:
3,4,5-trihydroxy-6-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]oxane-2-carboxylic acidFormula:
C15H16O8N2Smiles:
Cc1nnc(-c2cccc(OC3OC(C(=O)O)C(O)C(O)C3O)c2)o1Aglycone:
Cc1nnc(-c2cccc(O)c2)o1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 352.3 | Num_heavy_atoms: | 25 |
| TPSA: | 155.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD55509
Formula: C9H8O2N2
Smiles:
Cc1nnc(-c2cccc(O)c2)o1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 176.17 | Num_heavy_atoms: | 13 |
| TPSA: | 59.15 | NumAromaticRings: | 2 |
