Glycoside
GD098576
Name:
NoneFormula:
C22H31O8N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)C1CCC2CN1C(=O)N2OCc1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 8 |
| MolWt: | 465.5 | Num_heavy_atoms: | 33 |
| TPSA: | 141.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD41922
Formula: C16H21O4N3
Smiles:
O=C(NCCO)C1CCC2CN1C(=O)N2OCc1ccccc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 319.36 | Num_heavy_atoms: | 23 |
| TPSA: | 82.11 | NumAromaticRings: | 1 |
