Glycoside
GD122542
Name:
Ikarisoside EFormula:
C26H26O10Smiles:
CC1OC(Oc2c(-c3ccc(O)cc3)oc3c4c(cc(O)c3c2=O)OC(C)(C)C=C4)C(O)C(O)C1OAglycone:
CC1(C)C=Cc2c(cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc23)O1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 498.48 | Num_heavy_atoms: | 36 |
| TPSA: | 159.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD49392
Formula: C20H16O6
Smiles:
CC1(C)C=Cc2c(cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc23)O1| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 3.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 352.34 | Num_heavy_atoms: | 26 |
| TPSA: | 100.13 | NumAromaticRings: | 3 |
