Glycoside
GD135449
Name:
Broussonetine QFormula:
C30H55O15NSmiles:
O=C(CCCCCCCCCC1NC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O)CCCOC1OC(CO)C(O)C(O)C1OAglycone:
O=C(CCCO)CCCCCCCCCC1NC(CO)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.97 |
| AlogP: | -3.46 | Num_rotatable_bonds: | 20 |
| MolWt: | 669.76 | Num_heavy_atoms: | 46 |
| TPSA: | 268.32 | NumAromaticRings: | 0 |
Unique Aglycone
AD54173
Formula: C18H35O5N
Smiles:
O=C(CCCO)CCCCCCCCCC1NC(CO)C(O)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 14 |
| MolWt: | 345.48 | Num_heavy_atoms: | 24 |
| TPSA: | 110.02 | NumAromaticRings: | 0 |
