Glycoside

GD137844
Name:
NoneFormula:
C40H38O18Smiles:
COc1cc(C2=C(OC3OC(CO)C(O)C(O)C3O)C3=C[C](c4c(O)cc(O)c5c4OC(c4ccc(O)c(O)c4)C(O)C5)Oc4cc(O)cc(c43)[OH+]2)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)[OH+]2)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 18 | RingCount: | 8 |
HBD: | 12 | FractionCSP3: | 0.28 |
AlogP: | 1.77 | Num_rotatable_bonds: | 8 |
MolWt: | 806.73 | Num_heavy_atoms: | 58 |
TPSA: | 290.71 | NumAromaticRings: | 4 |
Unique Aglycone
AD47255
Formula: C34H29O13
Smiles:
COc1cc(C2=C(O)C3=CC(c4c(O)cc(O)c5c4OC(c4ccc(O)c(O)c4)C(O)C5)Oc4cc(O)cc(c43)[OH+]2)cc(OC)c1OHBA: | 13 | RingCount: | 7 |
HBD: | 9 | FractionCSP3: | 0.18 |
AlogP: | 4.67 | Num_rotatable_bonds: | 5 |
MolWt: | 645.59 | Num_heavy_atoms: | 47 |
TPSA: | 211.56 | NumAromaticRings: | 4 |