Glycoside

GD125253
Name:
Dracunculifoside MFormula:
C30H44O11Smiles:
CC(C)C1(O)CCC2(C)C(OC3OC(COC(=O)C=Cc4ccc(O)c(O)c4)C(O)C(O)C3O)CCC(C)(O)C2C1Aglycone:
CC(C)C1(O)CCC2(C)C(O)CCC(C)(O)C2C1.COC(=O)C=Cc1ccc(O)c(O)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 4 |
HBD: | 7 | FractionCSP3: | 0.7 |
AlogP: | 1.59 | Num_rotatable_bonds: | 7 |
MolWt: | 580.67 | Num_heavy_atoms: | 41 |
TPSA: | 186.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD03431
Formula: C10H10O4
Smiles:
COC(=O)C=Cc1ccc(O)c(O)c1HBA: | 4 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.1 |
AlogP: | 1.28 | Num_rotatable_bonds: | 2 |
MolWt: | 194.19 | Num_heavy_atoms: | 14 |
TPSA: | 66.76 | NumAromaticRings: | 1 |
AD50651
Formula: C15H28O3
Smiles:
CC(C)C1(O)CCC2(C)C(O)CCC(C)(O)C2C1HBA: | 3 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 1.0 |
AlogP: | 2.09 | Num_rotatable_bonds: | 1 |
MolWt: | 256.39 | Num_heavy_atoms: | 18 |
TPSA: | 60.69 | NumAromaticRings: | 0 |