Glycoside

GD022873
Name:
NoneFormula:
C35H38O17Smiles:
CC(=O)O[C@@H]1[C@H](O[C@@H]2[C@H](C)O[C@H](Oc3cc(O)c4c(c3)C(=O)c3cc(C)cc(O)c3C4=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)O[C@H](C)[C@H](O)[C@H]1OC(C)=OAglycone:
Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=OSugarmoiety:
CC(=O)OC1C(O)OC(C)C(OC2OC(C)C(O)C(OC(C)=O)C2OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 17 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.49 |
AlogP: | 1.52 | Num_rotatable_bonds: | 8 |
MolWt: | 730.67 | Num_heavy_atoms: | 52 |
TPSA: | 236.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD00700
Formula: C15H10O5
Smiles:
Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=OHBA: | 5 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.07 |
AlogP: | 1.89 | Num_rotatable_bonds: | 0 |
MolWt: | 270.24 | Num_heavy_atoms: | 20 |
TPSA: | 94.83 | NumAromaticRings: | 2 |