Glycoside

GD116575
Name:
NoneFormula:
C61H117O20NSmiles:
CCCCCCCCCCCCCCCCCCCCCCCC(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)CCCCCCCCCCCC(C)CAglycone:
CCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC(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: | 5.41 | Num_rotatable_bonds: | 50 |
MolWt: | 1184.59 | Num_heavy_atoms: | 82 |
TPSA: | 350.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD46316
Formula: C43H87O5N
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC(C)CHBA: | 6 | RingCount: | 0 |
HBD: | 5 | FractionCSP3: | 0.98 |
AlogP: | 11.94 | Num_rotatable_bonds: | 39 |
MolWt: | 698.17 | Num_heavy_atoms: | 49 |
TPSA: | 113.51 | NumAromaticRings: | 0 |