Glycoside
GD115248
Name:
Tuberosinone N-Beta-D-GlucosideFormula:
C23H19O10NSmiles:
O=C1C(=O)N(C2OC(CO)C(O)C(O)C2O)c2cc3ccc(O)cc3c3c4c(cc1c23)OCO4Aglycone:
O=C1Nc2cc3ccc(O)cc3c3c4c(cc(c23)C1=O)OCO4Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 469.4 | Num_heavy_atoms: | 34 |
| TPSA: | 166.22 | NumAromaticRings: | 3 |
Unique Aglycone
AD45552
Formula: C17H9O5N
Smiles:
O=C1Nc2cc3ccc(O)cc3c3c4c(cc(c23)C1=O)OCO4| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 307.26 | Num_heavy_atoms: | 23 |
| TPSA: | 84.86 | NumAromaticRings: | 3 |
