Glycoside
GD155809
Name:
2-[(10-hydroxy-7,7,8,10-tetramethyl-1,2,3,4,5,7,8,9,10,10a-decahydro-3-benzazocin-9-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H37O7NSmiles:
CC1C(OC2OC(CO)C(O)C(O)C2O)C(C)(O)C2CCNCCC=C2C1(C)CAglycone:
CC1C(O)C(C)(O)C2CCNCCC=C2C1(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.9 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 415.53 | Num_heavy_atoms: | 29 |
| TPSA: | 131.64 | NumAromaticRings: | 0 |
Unique Aglycone
AD61760
Formula: C15H27O2N
Smiles:
CC1C(O)C(C)(O)C2CCNCCC=C2C1(C)C| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.87 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 0 |
| MolWt: | 253.39 | Num_heavy_atoms: | 18 |
| TPSA: | 52.49 | NumAromaticRings: | 0 |
