Otanthusic acid; (E,E,E)-form, [5-(3-Methylbutanoyloxy)-3Z-pentenyl]amide
AlkaPlorer ID: AK308794
Synonym: None
IUPAC Name: None
Structure
SMILES: CC(C)CC(=O)OC/C=C/CCNC(=O)/C=C\C=C\C=C/C1=CC=CS1
InChI: InChI=1S/C21H27NO3S/c1-18(2)17-21(24)25-15-9-5-8-14-22-20(23)13-7-4-3-6-11-19-12-10-16-26-19/h3-7,9-13,16,18H,8,14-15,17H2,1-2H3,(H,22,23)/b4-3+,9-5+,11-6-,13-7-
InChIKey: UXKHBPOYZOPFIH-RQMMQMFXSA-N
Reference
CAS: 1470306-04-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Otanthus maritimus | Otanthus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 373.518
TPSA？: 55.4
MolLogP？: 4.525500000000004
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|