Glycoside

GD140264
Name:
Hopeaside CFormula:
C48H44O15Smiles:
OCC1OC(c2c(O)cc(O)cc2C(O)C(c2ccc(O)cc2)c2c(O)cc3c(c2C=Cc2ccc(O)cc2)C(c2cc(O)cc(O)c2)C(c2ccc(O)cc2)O3)C(O)C(O)C1OAglycone:
Oc1ccc(C=Cc2c(C(c3ccc(O)cc3)C(O)c3cc(O)cc(O)c3)c(O)cc3c2C(c2cc(O)cc(O)c2)C(c2ccc(O)cc2)O3)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 8 |
HBD: | 13 | FractionCSP3: | 0.21 |
AlogP: | 5.15 | Num_rotatable_bonds: | 10 |
MolWt: | 860.87 | Num_heavy_atoms: | 63 |
TPSA: | 281.45 | NumAromaticRings: | 6 |
Unique Aglycone
AD56561
Formula: C42H34O10
Smiles:
Oc1ccc(C=Cc2c(C(c3ccc(O)cc3)C(O)c3cc(O)cc(O)c3)c(O)cc3c2C(c2cc(O)cc(O)c2)C(c2ccc(O)cc2)O3)cc1HBA: | 10 | RingCount: | 7 |
HBD: | 9 | FractionCSP3: | 0.1 |
AlogP: | 7.63 | Num_rotatable_bonds: | 8 |
MolWt: | 698.72 | Num_heavy_atoms: | 52 |
TPSA: | 191.3 | NumAromaticRings: | 6 |