Glycoside
GD034391
Name:
NoneFormula:
C23H32O12N2Smiles:
O=C1NCC(c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](C[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3O)cc2)=C(O)N1Aglycone:
O=C1NCC(c2ccc(O)cc2)=C(O)N1Sugarmoiety:
OCC1OC(CC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.61 |
| AlogP: | -3.11 | Num_rotatable_bonds: | 7 |
| MolWt: | 528.51 | Num_heavy_atoms: | 37 |
| TPSA: | 230.66 | NumAromaticRings: | 1 |
Unique Aglycone
AD21873
Formula: C10H10O3N2
Smiles:
O=C1NCC(c2ccc(O)cc2)=C(O)N1| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.1 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 1 |
| MolWt: | 206.2 | Num_heavy_atoms: | 15 |
| TPSA: | 81.59 | NumAromaticRings: | 1 |
