Glycoside
GD103328
Name:
NoneFormula:
C23H35O9N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cccnc2O[C@H]2CCN(C(=O)OC(C)(C)C)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCC(Oc2ncccc2C(=O)NCCO)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 497.55 | Num_heavy_atoms: | 35 |
| TPSA: | 159.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD43733
Formula: C17H25O5N3
Smiles:
CC(C)(C)OC(=O)N1CCC(Oc2ncccc2C(=O)NCCO)C1| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.59 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 351.4 | Num_heavy_atoms: | 25 |
| TPSA: | 100.99 | NumAromaticRings: | 1 |
