Glycoside
GD150992
Name:
NoneFormula:
C30H34O12N3Smiles:
CNCCOc1c(OC2OC(C(=O)O)C(O)C(O)C2O)cc2c(c1O)C(O)=CC(c1ccc(OCCC3=NC(N)=C[CH+]3)cc1)O2Aglycone:
CNCCOc1c(O)cc2c(c1O)C(O)=CC(c1ccc(OCCC3=NC(N)=C[CH+]3)cc1)O2Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.37 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 12 |
| MolWt: | 628.61 | Num_heavy_atoms: | 45 |
| TPSA: | 235.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD56229
Formula: C24H26O6N3
Smiles:
CNCCOc1c(O)cc2c(c1O)C(O)=CC(c1ccc(OCCC3=NC(N)=C[CH+]3)cc1)O2| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.25 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 9 |
| MolWt: | 452.49 | Num_heavy_atoms: | 33 |
| TPSA: | 138.79 | NumAromaticRings: | 2 |
