Glycoside
GD037617
Name:
(9z)-n-[(2s,3r,4e)-1-(beta-d-glucopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]octadec-9-enamideFormula:
C42H79O8NSmiles:
CCCCCCCCC=CCCCCCCCC(=O)N[C@@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O)[C@H](O)C=CCCCCCCCCCCCCCAglycone:
CCCCCCCCC=CCCCCCCCC(=O)NC(CO)C(O)C=CCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | 7.94 | Num_rotatable_bonds: | 34 |
| MolWt: | 726.09 | Num_heavy_atoms: | 51 |
| TPSA: | 148.71 | NumAromaticRings: | 0 |
Unique Aglycone
AD23675
Formula: C36H69O3N
Smiles:
CCCCCCCCC=CCCCCCCCC(=O)NC(CO)C(O)C=CCCCCCCCCCCCCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | 10.12 | Num_rotatable_bonds: | 31 |
| MolWt: | 563.95 | Num_heavy_atoms: | 40 |
| TPSA: | 69.56 | NumAromaticRings: | 0 |
