Glycoside
GD006271
Name:
NoneFormula:
C31H49O9NSmiles:
CO[C@@H]1[C@H](O)[C@H](O)[C@H](C)O[C@H]1N(OC)[C@@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@H]2C[C@H](O)[C@]2(C)[C@H](C4=CC(=O)OC4)CC[C@@]32O)C1Aglycone:
CONC1CCC2(C)C(CCC3C2CC(O)C2(C)C(C4=CC(=O)OC4)CCC32O)C1Sugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 579.73 | Num_heavy_atoms: | 41 |
| TPSA: | 138.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD05202
Formula: C24H37O5N
Smiles:
CONC1CCC2(C)C(CCC3C2CC(O)C2(C)C(C4=CC(=O)OC4)CCC32O)C1| HBA: | 6 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | 2.73 | Num_rotatable_bonds: | 3 |
| MolWt: | 419.56 | Num_heavy_atoms: | 30 |
| TPSA: | 88.02 | NumAromaticRings: | 0 |
