Glycoside
GD086217
Name:
CitreoviridinFormula:
C23H30O6Smiles:
COc1cc(=O)oc(/C=C\C=C\C=C/C(C)=C\[C@@]2(C)O[C@@H](C)[C@](C)(O)[C@H]2O)c1CAglycone:
C=C(C)C=CC=CC=Cc1oc(=O)cc(OC)c1CSugarmoiety:
CC1OC(C)(O)C(O)C1(C)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 6 |
| MolWt: | 402.49 | Num_heavy_atoms: | 29 |
| TPSA: | 89.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD04125
Formula: C16H18O3
Smiles:
C=C(C)C=CC=CC=Cc1oc(=O)cc(OC)c1C| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.19 |
| AlogP: | 3.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 258.32 | Num_heavy_atoms: | 19 |
| TPSA: | 39.44 | NumAromaticRings: | 1 |
