Glycoside
GD098992
Name:
NoneFormula:
C23H35O7N2Smiles:
O=C(C(=O)N1CCC(OC2CC[NH+](Cc3ccccc3)CC2)CC1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1ccc(C[NH+]2CCC(OC3CCNCC3)CC2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -2.11 | Num_rotatable_bonds: | 9 |
| MolWt: | 451.54 | Num_heavy_atoms: | 32 |
| TPSA: | 131.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD42138
Formula: C17H27ON2
Smiles:
c1ccc(C[NH+]2CCC(OC3CCNCC3)CC2)cc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.65 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 275.42 | Num_heavy_atoms: | 20 |
| TPSA: | 25.7 | NumAromaticRings: | 1 |
