Glycoside
GD085425
Name:
NoneFormula:
C22H30O7NSmiles:
O=C(O)[C@H]1O[C@@H](Oc2ccc3c(c2)[C@@]24CCCC[C@@H]2[C@@H](C3)[NH2+]CC4)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
Oc1ccc2c(c1)C13CCCCC1C(C2)[NH2+]CC3Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.68 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 420.48 | Num_heavy_atoms: | 30 |
| TPSA: | 133.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD38150
Formula: C16H22ON
Smiles:
Oc1ccc2c(c1)C13CCCCC1C(C2)[NH2+]CC3| HBA: | 2 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 0 |
| MolWt: | 244.36 | Num_heavy_atoms: | 18 |
| TPSA: | 36.84 | NumAromaticRings: | 1 |
