Glycoside
GD154666
Name:
3',4'-Dideoxy-6'-N-Methylbutirosin AFormula:
C22H43O10N5Smiles:
CNCC1CCC(N)C(OC2C(N)CC(N=C(O)C(O)CCN)C(O)C2OC2OC(CO)C(O)C2O)O1Aglycone:
CNCC1CCC(N)C(OC2C(N)CC(N=C(O)C(O)CCN)C(O)C2O)O1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 0.95 |
| AlogP: | -4.63 | Num_rotatable_bonds: | 11 |
| MolWt: | 537.61 | Num_heavy_atoms: | 37 |
| TPSA: | 260.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD61407
Formula: C17H35O6N5
Smiles:
CNCC1CCC(N)C(OC2C(N)CC(N=C(O)C(O)CCN)C(O)C2O)O1| HBA: | 11 | RingCount: | 2 |
| HBD: | 11 | FractionCSP3: | 0.94 |
| AlogP: | -3.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 405.5 | Num_heavy_atoms: | 28 |
| TPSA: | 201.83 | NumAromaticRings: | 0 |
