Glycoside
GD034062
Name:
Cripowelline BFormula:
C25H33O11NSmiles:
CO[C@@H]1[C@@H](O[C@@H]2CC(=O)[C@@H]3CCN(Cc4cc5c(cc43)OCO5)C(=O)[C@H]2O)O[C@@H](CO)[C@@H](OC)[C@H]1OCAglycone:
O=C1CC(O)C(O)C(=O)N2CCC1c1cc3c(cc1C2)OCO3Sugarmoiety:
COC1C(O)OC(CO)C(OC)C1OCOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 523.54 | Num_heavy_atoms: | 37 |
| TPSA: | 142.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD05088
Formula: C16H17O6N
Smiles:
O=C1CC(O)C(O)C(=O)N2CCC1c1cc3c(cc1C2)OCO3| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 0 |
| MolWt: | 319.31 | Num_heavy_atoms: | 23 |
| TPSA: | 96.3 | NumAromaticRings: | 1 |
