Glycoside

GD114927
Name:
hopeaside eFormula:
C48H44O16Smiles:
OCC1OC(c2c(O)cc(O)cc2C(O)C(c2ccc(O)cc2)c2c(O)cc3c4c2C(O)C(c2ccc(O)cc2)c2c(O)cc(O)cc2C4C(c2ccc(O)cc2)O3)C(O)C(O)C1OAglycone:
Oc1ccc(C2Oc3cc(O)c(C(c4ccc(O)cc4)C(O)c4cc(O)cc(O)c4)c4c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C4O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 9 |
HBD: | 14 | FractionCSP3: | 0.25 |
AlogP: | 4.16 | Num_rotatable_bonds: | 8 |
MolWt: | 876.86 | Num_heavy_atoms: | 64 |
TPSA: | 301.68 | NumAromaticRings: | 6 |
Unique Aglycone
AD45367
Formula: C42H34O11
Smiles:
Oc1ccc(C2Oc3cc(O)c(C(c4ccc(O)cc4)C(O)c4cc(O)cc(O)c4)c4c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C4O)cc1HBA: | 11 | RingCount: | 8 |
HBD: | 10 | FractionCSP3: | 0.14 |
AlogP: | 6.64 | Num_rotatable_bonds: | 6 |
MolWt: | 714.72 | Num_heavy_atoms: | 53 |
TPSA: | 211.53 | NumAromaticRings: | 6 |