Glycoside

GD140046
Name:
NoneFormula:
C29H27O13Smiles:
Oc1ccc(C2C=C3C(OC4OC(C[OH2+])C(O)C(O)C4O)=C(c4cc(O)c(O)c(O)c4)Oc4cc(O)cc(c43)O2)cc1Aglycone:
OC1=C(c2cc(O)c(O)c(O)c2)Oc2cc(O)cc3c2C1=CC(c1ccc(O)cc1)O3Sugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 6 |
HBD: | 10 | FractionCSP3: | 0.24 |
AlogP: | 1.04 | Num_rotatable_bonds: | 5 |
MolWt: | 583.52 | Num_heavy_atoms: | 42 |
TPSA: | 221.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD56465
Formula: C23H16O8
Smiles:
OC1=C(c2cc(O)c(O)c(O)c2)Oc2cc(O)cc3c2C1=CC(c1ccc(O)cc1)O3HBA: | 8 | RingCount: | 5 |
HBD: | 6 | FractionCSP3: | 0.04 |
AlogP: | 4.05 | Num_rotatable_bonds: | 2 |
MolWt: | 420.37 | Num_heavy_atoms: | 31 |
TPSA: | 139.84 | NumAromaticRings: | 3 |