Glycoside
GD063412
Name:
NoneFormula:
C16H29O7N2Smiles:
CC1([NH+]2CCOCC2)CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC1Aglycone:
CC1([NH+]2CCOCC2)CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -4.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.42 | Num_heavy_atoms: | 25 |
| TPSA: | 131.97 | NumAromaticRings: | 0 |
Unique Aglycone
AD30547
Formula: C10H21ON2
Smiles:
CC1([NH+]2CCOCC2)CCNCC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 1 |
| MolWt: | 185.29 | Num_heavy_atoms: | 13 |
| TPSA: | 25.7 | NumAromaticRings: | 0 |
