Glycoside
GD116494
Name:
2-hydroxy-N-(3-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}undec-5-en-2-yl)-2-methyldec-4-enamideFormula:
C28H51O9NSmiles:
CCCCCC=CCC(O)C(COC1OC(CO)C(O)C(O)C1O)N=C(O)C(C)(O)CC=CCCCCCAglycone:
CCCCCC=CCC(O)C(CO)N=C(O)C(C)(O)CC=CCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.82 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 19 |
| MolWt: | 545.71 | Num_heavy_atoms: | 38 |
| TPSA: | 172.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD46268
Formula: C22H41O4N
Smiles:
CCCCCC=CCC(O)C(CO)N=C(O)C(C)(O)CC=CCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.77 |
| AlogP: | 4.47 | Num_rotatable_bonds: | 16 |
| MolWt: | 383.57 | Num_heavy_atoms: | 27 |
| TPSA: | 93.28 | NumAromaticRings: | 0 |
