Glycoside
GD130849
Name:
Isotan BFormula:
C14H15O7NSmiles:
O=C(Oc1c[nH]c2ccccc12)C1OC(O)(CO)C(O)C1OAglycone:
O=COc1c[nH]c2ccccc12Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 309.27 | Num_heavy_atoms: | 22 |
| TPSA: | 132.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD53018
Formula: C9H7O2N
Smiles:
O=COc1c[nH]c2ccccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 2 |
| MolWt: | 161.16 | Num_heavy_atoms: | 12 |
| TPSA: | 42.09 | NumAromaticRings: | 2 |
