Glycoside
GD112070
Name:
3'-Deoxytalopiericidin A1Formula:
C31H47O8NSmiles:
C/C=C(\C)[C@H](O)[C@H](C)/C=C(C)/C=C/C/C(C)=C/Cc1nc(OC)c(OC)c(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)c1CAglycone:
CC=C(C)C(O)C(C)C=C(C)C=CCC(C)=CCc1nc(OC)c(OC)c(O)c1CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | 3.96 | Num_rotatable_bonds: | 12 |
| MolWt: | 561.72 | Num_heavy_atoms: | 40 |
| TPSA: | 130.73 | NumAromaticRings: | 1 |
Unique Aglycone
AD18886
Formula: C25H37O4N
Smiles:
CC=C(C)C(O)C(C)C=C(C)C=CCC(C)=CCc1nc(OC)c(OC)c(O)c1C| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.48 |
| AlogP: | 5.46 | Num_rotatable_bonds: | 10 |
| MolWt: | 415.57 | Num_heavy_atoms: | 30 |
| TPSA: | 71.81 | NumAromaticRings: | 1 |
