Glycoside

GD132720
Name:
Decaprenoxanthin MonoglucosideFormula:
C56H82O7Smiles:
CC(C=CC=C(C)C=CC1C(C)=CCC(CC=C(C)CO)C1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1C(C)=CCC(CC=C(C)COC2OC(CO)C(O)C(O)C2O)C1(C)CAglycone:
CC(C=CC=C(C)C=CC1C(C)=CCC(CC=C(C)CO)C1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1C(C)=CCC(CC=C(C)CO)C1(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 7 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.54 |
AlogP: | 11.25 | Num_rotatable_bonds: | 19 |
MolWt: | 867.27 | Num_heavy_atoms: | 63 |
TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD50043
Formula: C50H72O2
Smiles:
CC(C=CC=C(C)C=CC1C(C)=CCC(CC=C(C)CO)C1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1C(C)=CCC(CC=C(C)CO)C1(C)CHBA: | 2 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.48 |
AlogP: | 13.43 | Num_rotatable_bonds: | 16 |
MolWt: | 705.12 | Num_heavy_atoms: | 52 |
TPSA: | 40.46 | NumAromaticRings: | 0 |