methyl octadec-7-ynoate

• ChemBase ID: 132950
• Molecular Formular: C19H34O2
• Molecular Mass: 294.47206
• Monoisotopic Mass: 294.25588033
• SMILES: CCCCCCCCCCC#CCCCCCC(=O)OC
• Canonical SMILES: CCCCCCCCCCC#CCCCCCC(=O)OC
• InChI: InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3-11,14-18H2,1-2H3
• InChIKey: ALSHYECRTIFLAI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl octadec-7-ynoate
• IUPAC Traditional name: methyl octadec-7-ynoate
• Synonyms: Anti-Orexin A antibody produced in rabbit

Database IDs

• MDL Number: MFCD01865115
• PubChem SID: 162227227; 24898073
• PubChem CID: 535164

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 6.876321
• LogD (pH = 7.4): 6.876321
• Log P: 6.876321
• Molar Refractivity: 90.4161 cm^3
• Polarizability: 35.40512 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 16
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: buffered aqueous solution

Safety Information

• German water hazard class: -
• Storage Temperature: -20°C

Pharmacology Properties

• Gene Information: human ... HCRT(3060)mouse ... Hcrt(15171)rat ... Hcrt(25723)

Product Information

• Application(s): indirect ELISA: 1:20,000; radioimmunoassay: 1:300,000
• Shipped in: dry ice
• Clone: polyclonal
• Species Reactivity: rat, human, mouse
• Antibody Form: IgG fraction of antiserum

DETAILS

Sigma Aldrich - O9756

Immunogen
synthetic peptide corresponding to the N-terminus of human orexin A (amino acids 1-17 with disulfide bridge between cysteines 6-12 and 7-14 and C-terminally added Gly-Lys), conjugated to KLH. This sequence is identical in mouse and rat orexin A and is different from the orexin B sequence.
Physical form
Solution in 0.01 M phosphate buffered saline, pH 7.4, containing 15 mM sodium azide.