Glycoside
GD016040
Name:
NoneFormula:
C24H31O12NSmiles:
CO[C@H]1[C@H](O)[C@@H]2OCO[C@H]2[C@@H](O)[C@H]1NC(=O)C(C)=Cc1ccc(O[C@@H]2O[C@H](C(C)=O)[C@H](O)[C@H]2O)c(O)c1Aglycone:
COC1C(O)C2OCOC2C(O)C1NC(=O)C(C)=Cc1ccc(O)c(O)c1Sugarmoiety:
CC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 7 |
| MolWt: | 525.51 | Num_heavy_atoms: | 37 |
| TPSA: | 193.47 | NumAromaticRings: | 1 |
Unique Aglycone
AD11593
Formula: C18H23O8N
Smiles:
COC1C(O)C2OCOC2C(O)C1NC(=O)C(C)=Cc1ccc(O)c(O)c1| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 381.38 | Num_heavy_atoms: | 27 |
| TPSA: | 137.71 | NumAromaticRings: | 1 |
