Glycoside

GD006899
Name:
NoneFormula:
C29H32O12Smiles:
COC1C(C)OC(O[C@@H]2c3c(cc4c(c3O)C(=O)c3c(O)cccc3C4=O)C(=O)[C@@](C)(O)[C@H]2OC)C(OC)C1OCAglycone:
COC1C(O)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C(=O)C1(C)OSugarmoiety:
COC1C(C)OC(O)C(OC)C1OCOther Identifiers
Properties
HBA: | 12 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.48 |
AlogP: | 1.68 | Num_rotatable_bonds: | 6 |
MolWt: | 572.56 | Num_heavy_atoms: | 41 |
TPSA: | 167.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD01755
Formula: C20H16O8
Smiles:
COC1C(O)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C(=O)C1(C)OHBA: | 8 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.25 |
AlogP: | 0.87 | Num_rotatable_bonds: | 1 |
MolWt: | 384.34 | Num_heavy_atoms: | 28 |
TPSA: | 141.36 | NumAromaticRings: | 2 |