Glycoside
GD153763
Name:
3-(benzyloxy)-N-[4,5-bis(benzyloxy)-6-(hydroxymethyl)-2-(prop-2-en-1-yloxy)oxan-3-yl]tetradecanamideFormula:
C44H61O7NSmiles:
C=CCOC1OC(CO)C(OCc2ccccc2)C(OCc2ccccc2)C1N=C(O)CC(CCCCCCCCCCC)OCc1ccccc1Aglycone:
CCCCCCCCCCCC(CC(=N)O)OCc1ccccc1.OCc1ccccc1.OCc1ccccc1Sugarmoiety:
C=CCOC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.52 |
| AlogP: | 9.3 | Num_rotatable_bonds: | 26 |
| MolWt: | 715.97 | Num_heavy_atoms: | 52 |
| TPSA: | 98.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
AD51019
Formula: C21H35O2N
Smiles:
CCCCCCCCCCCC(CC(=N)O)OCc1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | 6.42 | Num_rotatable_bonds: | 15 |
| MolWt: | 333.52 | Num_heavy_atoms: | 24 |
| TPSA: | 53.31 | NumAromaticRings: | 1 |
