Glycoside
GD079604
Name:
NoneFormula:
C19H31O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccncc2N2CC[NH+](C)CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
C[NH+]1CCN(c2cnccc2C(=O)NCCO)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -3.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.48 | Num_heavy_atoms: | 29 |
| TPSA: | 128.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD36381
Formula: C13H21O2N4
Smiles:
C[NH+]1CCN(c2cnccc2C(=O)NCCO)CC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 265.34 | Num_heavy_atoms: | 19 |
| TPSA: | 69.9 | NumAromaticRings: | 1 |
