Glycoside
GD158107
Name:
NoneFormula:
C33H38O9N2Smiles:
Nc1ccc(CC2CCCCC2CC2=CC3C(=[O+])c4cccc(OC5OC(CO)C(O)C(O)C5O)c4C(=O)C3C(O)=C2)cn1Aglycone:
Nc1ccc(CC2CCCCC2CC2=CC3C(=[OH+])c4cccc(O)c4C(=O)C3C(O)=C2)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.48 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 606.67 | Num_heavy_atoms: | 44 |
| TPSA: | 195.49 | NumAromaticRings: | 2 |
Unique Aglycone
AD62438
Formula: C27H29O4N2
Smiles:
Nc1ccc(CC2CCCCC2CC2=CC3C(=[OH+])c4cccc(O)c4C(=O)C3C(O)=C2)cn1| HBA: | 6 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | 4.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 445.54 | Num_heavy_atoms: | 33 |
| TPSA: | 117.84 | NumAromaticRings: | 2 |
