Glycoside
GD121310
Name:
6'-N-Methylbutirosin BFormula:
C22H43O12N5Smiles:
CNCC1OC(OC2C(N)CC(N=C(O)C(O)CCN)C(O)C2OC2OC(CO)C(O)C2O)C(N)C(O)C1OAglycone:
NCCC(O)C(O)=NC1CC(N)C(O)C(O)C1OSugarmoiety:
CNCC1OC(O)C(N)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 15 | FractionCSP3: | 0.95 |
| AlogP: | -6.68 | Num_rotatable_bonds: | 11 |
| MolWt: | 569.61 | Num_heavy_atoms: | 39 |
| TPSA: | 301.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD48824
Formula: C10H21O5N3
Smiles:
NCCC(O)C(O)=NC1CC(N)C(O)C(O)C1O| HBA: | 8 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.9 |
| AlogP: | -3.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 263.29 | Num_heavy_atoms: | 18 |
| TPSA: | 165.55 | NumAromaticRings: | 0 |
