Glycoside
GD088015
Name:
NoneFormula:
C22H25O7N3Smiles:
O=C(C(=O)N1CC[C@]2(COCc3cnc(-c4ccccc4)nc32)C1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1ccc(-c2ncc3c(n2)C2(CCNC2)COC3)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 6 |
| MolWt: | 443.46 | Num_heavy_atoms: | 32 |
| TPSA: | 153.31 | NumAromaticRings: | 2 |
Unique Aglycone
AD38569
Formula: C16H17ON3
Smiles:
c1ccc(-c2ncc3c(n2)C2(CCNC2)COC3)cc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 267.33 | Num_heavy_atoms: | 20 |
| TPSA: | 47.04 | NumAromaticRings: | 2 |
