Glycoside
GD150579
Name:
19-ethenyl-18-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-17-oxa-3,13-diazatetracyclo[11.8.0.0â´,â¹.0¹âµ,²â°]henicosa-4,6,8,15-tetraene-2,10,14-trioneFormula:
C26H30O10N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N3CCC(=O)c4ccccc4N=C(O)C3CC21Aglycone:
C=CC1C(O)OC=C2C(=O)N3CCC(=O)c4ccccc4N=C(O)C3CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 530.53 | Num_heavy_atoms: | 38 |
| TPSA: | 178.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD60134
Formula: C20H20O5N2
Smiles:
C=CC1C(O)OC=C2C(=O)N3CCC(=O)c4ccccc4N=C(O)C3CC21| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.35 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 368.39 | Num_heavy_atoms: | 27 |
| TPSA: | 99.43 | NumAromaticRings: | 1 |
