Glycoside
GD120764
Name:
2-Amino-4,8-Octadecadiene-1,3-Diol; (2S,3R,4E,8E)-Form, N-(2R-Hydroxytetradecanoyl), 1-O-β-D-GlucopyranosideFormula:
C38H71O9NSmiles:
CCCCCCCCCC=CCCC=CC(O)C(COC1OC(CO)C(O)C(O)C1O)N=C(O)C(O)CCCCCCCCCCCCAglycone:
CCCCCCCCCC=CCCC=CC(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.87 |
| AlogP: | 6.19 | Num_rotatable_bonds: | 30 |
| MolWt: | 685.98 | Num_heavy_atoms: | 48 |
| TPSA: | 172.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD48551
Formula: C32H61O4N
Smiles:
CCCCCCCCCC=CCCC=CC(O)C(CO)N=C(O)C(O)CCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.84 |
| AlogP: | 8.37 | Num_rotatable_bonds: | 27 |
| MolWt: | 523.84 | Num_heavy_atoms: | 37 |
| TPSA: | 93.28 | NumAromaticRings: | 0 |
