Glycoside

GD143463
Name:
NoneFormula:
C40H39O18Smiles:
COc1cc(C2=C(OC3OC(C[OH2+])C(O)C(O)C3O)C3=CC(c4c(O)cc(O)c5c4OC(c4ccc(O)c(O)c4)C(O)C5)Oc4cc(O)cc(c43)O2)cc(OC)c1OAglycone:
COc1cc(C2=C(O)C3=CC(c4c(O)cc(O)c5c4OC(c4ccc(O)c(O)c4)C(O)C5)Oc4cc(O)cc(c43)O2)cc(OC)c1OSugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1OOther Identifiers
Properties
HBA: | 18 | RingCount: | 8 |
HBD: | 12 | FractionCSP3: | 0.3 |
AlogP: | 1.8 | Num_rotatable_bonds: | 8 |
MolWt: | 807.73 | Num_heavy_atoms: | 58 |
TPSA: | 289.81 | NumAromaticRings: | 4 |
Unique Aglycone
AD57698
Formula: C34H28O13
Smiles:
COc1cc(C2=C(O)C3=CC(c4c(O)cc(O)c5c4OC(c4ccc(O)c(O)c4)C(O)C5)Oc4cc(O)cc(c43)O2)cc(OC)c1OHBA: | 13 | RingCount: | 7 |
HBD: | 8 | FractionCSP3: | 0.18 |
AlogP: | 4.81 | Num_rotatable_bonds: | 5 |
MolWt: | 644.59 | Num_heavy_atoms: | 47 |
TPSA: | 207.99 | NumAromaticRings: | 4 |