Glycoside
GD027178
Name:
NoneFormula:
C36H45O14NSmiles:
CNC1C(O)C2Oc3c(cc(O)c4c3C(=O)c3cc5c(c(O)c3C4=O)C(OC3OC(C)C(OC)C(C)(OC)C3OC)CC(C)(O)C5)C(C)(O2)C1OAglycone:
CNC1C(O)C2Oc3c(cc(O)c4c3C(=O)c3cc5c(c(O)c3C4=O)C(O)CC(C)(O)C5)C(C)(O2)C1OSugarmoiety:
COC1C(C)OC(O)C(OC)C1(C)OCOther Identifiers
Properties
| HBA: | 15 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 715.75 | Num_heavy_atoms: | 51 |
| TPSA: | 211.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD17884
Formula: C26H27O10N
Smiles:
CNC1C(O)C2Oc3c(cc(O)c4c3C(=O)c3cc5c(c(O)c3C4=O)C(O)CC(C)(O)C5)C(C)(O2)C1O| HBA: | 11 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 513.5 | Num_heavy_atoms: | 37 |
| TPSA: | 186.01 | NumAromaticRings: | 2 |
