Glycoside
GD124602
Name:
PassiguatemalinFormula:
C12H19O8NSmiles:
N#CC1(OC2OC(CO)C(O)C(O)C2O)CCC(O)C1OAglycone:
N#CC1(O)CCC(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.92 |
| AlogP: | -3.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 305.28 | Num_heavy_atoms: | 21 |
| TPSA: | 163.63 | NumAromaticRings: | 0 |
Unique Aglycone
AD50352
Formula: C6H9O3N
Smiles:
N#CC1(O)CCC(O)C1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.83 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 143.14 | Num_heavy_atoms: | 10 |
| TPSA: | 84.48 | NumAromaticRings: | 0 |
