Glycoside
GD130153
Name:
NoneFormula:
C65H112O25N2Smiles:
CCCCC(OC1OCC(O)C(OC2OCC(OC3OCC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(O)C2O)C1OC1OCC(OC(C)=O)C(OC(C)=O)C1O)C(O)CCCCCCCC(=O)CCCCCCCCCCCCCC(O)=NCCCCCN(C)CAglycone:
CCCCC(O)C(O)CCCCCCCC(=O)CCCCCCCCCCCCCC(O)=NCCCCCN(C)CSugarmoiety:
CC(=O)OC1COC(OC2C(O)OCC(O)C2OC2OCC(OC3OCC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(O)C2O)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 27 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.89 |
| AlogP: | 5.67 | Num_rotatable_bonds: | 45 |
| MolWt: | 1321.6 | Num_heavy_atoms: | 92 |
| TPSA: | 359.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD52737
Formula: C35H70O4N2
Smiles:
CCCCC(O)C(O)CCCCCCCC(=O)CCCCCCCCCCCCCC(O)=NCCCCCN(C)C| HBA: | 6 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.94 |
| AlogP: | 8.96 | Num_rotatable_bonds: | 32 |
| MolWt: | 582.96 | Num_heavy_atoms: | 41 |
| TPSA: | 93.36 | NumAromaticRings: | 0 |
Sugarmoiety
SD05080
CC(=O)OC1COC(OC2C(O)OCC(O)C2OC2OCC(OC3OCC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(O)C2O)C(O)C1OC(C)=O