Glycoside
GD036891
Name:
NoneFormula:
C20H29O9NSmiles:
COc1cc2c(cc1O)CCC(C)(CCNC(=O)C[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O)O2Aglycone:
COc1cc2c(cc1O)CCC(C)(CCNC(C)=O)O2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 427.45 | Num_heavy_atoms: | 30 |
| TPSA: | 157.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD23259
Formula: C15H21O4N
Smiles:
COc1cc2c(cc1O)CCC(C)(CCNC(C)=O)O2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 279.34 | Num_heavy_atoms: | 20 |
| TPSA: | 67.79 | NumAromaticRings: | 1 |
