Glycoside
GD080830
Name:
NoneFormula:
C19H25O8N3Smiles:
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)ccc21Aglycone:
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCCO)ccc21Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 423.42 | Num_heavy_atoms: | 30 |
| TPSA: | 163.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD36490
Formula: C13H15O4N3
Smiles:
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCCO)ccc21| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 277.28 | Num_heavy_atoms: | 20 |
| TPSA: | 104.19 | NumAromaticRings: | 2 |
