Glycoside
GD155025
Name:
N-({3,4-dihydroxy-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]oxolan-2-yl}methyl)cyclopentanecarboxamideFormula:
C19H32O5N2Smiles:
CC1CCN(C(=O)CC2OC(CN=C(O)C3CCCC3)C(O)C2O)CC1Aglycone:
CC(=O)N1CCC(C)CC1.CN=C(O)C1CCCC1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.89 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 368.47 | Num_heavy_atoms: | 26 |
| TPSA: | 102.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD22961
Formula: C8H15ON
Smiles:
CC(=O)N1CCC(C)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.88 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 0 |
| MolWt: | 141.21 | Num_heavy_atoms: | 10 |
| TPSA: | 20.31 | NumAromaticRings: | 0 |
AD45312
Formula: C7H13ON
Smiles:
CN=C(O)C1CCCC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 127.19 | Num_heavy_atoms: | 9 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
