Glycoside
GD000380
Name:
NoneFormula:
C11H13O5N3Smiles:
O=c1[nH]cnc2c(C3OC(CO)C(O)C3O)c[nH]c12Aglycone:
O=c1[nH]cnc2cc[nH]c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 267.24 | Num_heavy_atoms: | 19 |
| TPSA: | 131.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD00430
Formula: C6H5ON3
Smiles:
O=c1[nH]cnc2cc[nH]c12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.13 | Num_heavy_atoms: | 10 |
| TPSA: | 61.54 | NumAromaticRings: | 2 |
