Glycoside

GD018787
Name:
AURANTOSIDE GFormula:
C24H27O8N2ClSmiles:
CC(Cl)=CC=CC=CC=CC=CC(O)=C1C(=O)[C@H](CC(N)=O)N([C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)C1=OAglycone:
CC(Cl)=CC=CC=CC=CC=CC(O)=C1C(=O)NC(CC(N)=O)C1=OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 2 |
HBD: | 6 | FractionCSP3: | 0.35 |
AlogP: | 0.26 | Num_rotatable_bonds: | 8 |
MolWt: | 494.93 | Num_heavy_atoms: | 34 |
TPSA: | 170.62 | NumAromaticRings: | 0 |
Unique Aglycone
AD13187
Formula: C19H19O4N2Cl
Smiles:
CC(Cl)=CC=CC=CC=CC=CC(O)=C1C(=O)NC(CC(N)=O)C1=OHBA: | 6 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.17 |
AlogP: | 2.11 | Num_rotatable_bonds: | 7 |
MolWt: | 362.81 | Num_heavy_atoms: | 25 |
TPSA: | 109.49 | NumAromaticRings: | 0 |