Glycoside
GD022372
Name:
CYCLOPOSINEFormula:
C33H51O7NSmiles:
CC1=C2C[C@@H]3[C@H](CC=C4C[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@]43C)[C@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2CAglycone:
CC1=C2CC3C(CC=C4CC(O)CCC43C)C2CCC12OC1CC(C)CNC1C2CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 573.77 | Num_heavy_atoms: | 41 |
| TPSA: | 120.64 | NumAromaticRings: | 0 |
Unique Aglycone
AD15173
Formula: C27H41O2N
Smiles:
CC1=C2CC3C(CC=C4CC(O)CCC43C)C2CCC12OC1CC(C)CNC1C2C| HBA: | 3 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.85 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 411.63 | Num_heavy_atoms: | 30 |
| TPSA: | 41.49 | NumAromaticRings: | 0 |
