6-Hydroxy-2-heptenoic acid; (R,E)-form, 4-Carboxyphenylamide, O-(3,6-dideoxy-α-L-arabino-hexopyranoside)
AlkaPlorer ID: AK301152
Synonym: Ascaroside ΔC7 PABA
IUPAC Name: None
Structure
SMILES: CC(CC/C=C/C(=O)NC1=CC=C(C(=O)O)C=C1)OC1OC(C)C(O)CC1O
InChI: InChI=1S/C20H27NO7/c1-12(27-20-17(23)11-16(22)13(2)28-20)5-3-4-6-18(24)21-15-9-7-14(8-10-15)19(25)26/h4,6-10,12-13,16-17,20,22-23H,3,5,11H2,1-2H3,(H,21,24)(H,25,26)/b6-4+
InChIKey: WMKIQPAVTRWYKZ-GQCTYLIASA-N
Reference
CAS: 1172120-40-9
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | Caenorhabditis | Rhabditidae | Rhabditida | Chromadorea | Nematoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 393.43600000000015
TPSA？: 125.32000000000002
MolLogP？: 1.9214999999999995
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|