Glycoside
GD115401
Name:
NoneFormula:
C59H113O20NSmiles:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(OC2OC(C(O)CO)C(O)C2OC2OC(C(O)CO)C(O)C2O)C1O)C(O)C(O)CCCCCCCCCCC(C)CAglycone:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCC(C)CSugarmoiety:
OCC(O)C1OC(OC2C(OC3C(O)C(O)OC(CO)C3O)OC(C(O)CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 3 |
| HBD: | 14 | FractionCSP3: | 0.98 |
| AlogP: | 4.63 | Num_rotatable_bonds: | 48 |
| MolWt: | 1156.54 | Num_heavy_atoms: | 80 |
| TPSA: | 350.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD45643
Formula: C41H83O5N
Smiles:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCC(C)C| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.98 |
| AlogP: | 11.16 | Num_rotatable_bonds: | 37 |
| MolWt: | 670.12 | Num_heavy_atoms: | 47 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |