Glycoside

GD124080
Name:
F-ViFormula:
C34H54O11Smiles:
C=CC(C)(C)OCC1OC(OC2C3=C(C(C)CO)CC(O)C3(C)C=C3C(COC)CCC3C(C)C2O)C(O)C(O)C1OC(C)=OAglycone:
C=CC(C)(C)OC.COCC1CCC2C1=CC1(C)C(=C(C(C)CO)CC1O)C(O)C(O)C2CSugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.79 |
AlogP: | 2.04 | Num_rotatable_bonds: | 11 |
MolWt: | 638.8 | Num_heavy_atoms: | 45 |
TPSA: | 164.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD23211
Formula: C6H12O
Smiles:
C=CC(C)(C)OCHBA: | 1 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 1.6 | Num_rotatable_bonds: | 2 |
MolWt: | 100.16 | Num_heavy_atoms: | 7 |
TPSA: | 9.23 | NumAromaticRings: | 0 |
AD45444
Formula: C21H34O5
Smiles:
COCC1CCC2C1=CC1(C)C(=C(C(C)CO)CC1O)C(O)C(O)C2CHBA: | 5 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.81 |
AlogP: | 1.65 | Num_rotatable_bonds: | 4 |
MolWt: | 366.5 | Num_heavy_atoms: | 26 |
TPSA: | 90.15 | NumAromaticRings: | 0 |