Glycoside
GD053959
Name:
NoneFormula:
C14H23O6N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CCn2cccn2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CCn1cccn1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 7 |
| MolWt: | 329.35 | Num_heavy_atoms: | 23 |
| TPSA: | 126.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD27490
Formula: C8H13O2N3
Smiles:
O=C(CCn1cccn1)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 183.21 | Num_heavy_atoms: | 13 |
| TPSA: | 67.15 | NumAromaticRings: | 1 |
