Glycoside
GD057676
Name:
NoneFormula:
C13H21O7N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2=NNC(=O)CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C1CCC(C(=O)NCCO)=NN1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | -2.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.32 | Num_heavy_atoms: | 23 |
| TPSA: | 149.71 | NumAromaticRings: | 0 |
Unique Aglycone
AD28940
Formula: C7H11O3N3
Smiles:
O=C1CCC(C(=O)NCCO)=NN1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 185.18 | Num_heavy_atoms: | 13 |
| TPSA: | 90.79 | NumAromaticRings: | 0 |
