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Aliphatics

Myristoleic Acid

9(Z)-十四碳烯酸

PHY-NP-12527 · Natural product research catalog

Catalog numberPHY-NP-12527
CAS number544-64-9
Molecular formulaC14H26O2
Molecular weight226.36 g/mol
Chemical classAliphatics
Main reported sourceCassia fistula
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Myristoleic Acid

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Product information

Myristoleic Acid is listed in the Aliphatics section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name(Z)-tetradec-9-enoic acid
SMILESCCCC/C=C\CCCCCCCC(=O)O
InChIKeyYWWVWXASSLXJHU-WAYWQWQTSA-N
Subclass / scaffoldFatty Acids and Conjugates:Unsaturated fatty acids
PubChem CID5281119

Computed properties

Exact mass (Da)226.1933Predicted LogP4.5481
Predicted TPSA (Ų)37.3H-bond donors1
H-bond acceptors1Rotatable bonds11

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count0
Aromatic rings0
Fraction Csp³0.786
Synthetic accessibility score2.03
QED score0.414
Lipinski rule violations0
NPClassifier pathwayFatty acids
NPClassifier superclassFatty Acids and Conjugates
NPClassifier classUnsaturated fatty acids
Parent SMILESCCCC/C=C\CCCCCCCC(=O)O
Parent formulaC14H26O2
Parent molecular weight226.36
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceCassia fistula
Reported source familiesApocynaceae; Fabaceae; Polygonaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesCassia fistula[2]; Dermonema abbottiae[2]; Homo sapiens[2]; Caenorhabditis elegans[1]; Cassia javanica[1]; Chamerion dodonaei[1]; Citrullus colocynthis[1]; Diplotaxis harra[1]; Epilobium dodonaei[1]; Erucaria microcarpa[1]; Escherichia coli[1]; Fagopyrum esculentum[1]; Gladiolus italicus[1]; Gossypium hirsutum[1]; Hoya australis[1]
All reported source familiesApocynaceae[19]; Fabaceae[6]; Polygonaceae[4]; Onagraceae[2]; Brassicaceae[2]; Asteraceae[2]
Genus / family recordsDioscorea[1]; Streptomyces[1]
LOTUS species records47
LOTUS reference records22
COCONUT occurrence recordsAreca Catechu; Bos taurus; Caenorhabditis elegans; Cassia fistula; Cassia javanica; Chamerion dodonaei; Citrullus colocynthis; Dermonema abbottiae; Dioscorea; Diplotaxis harra; Elaeis Guineensis; Epilobium dodonaei; Erucaria microcarpa; Escherichia coli; Fagopyrum esculentum; Gladiolus italicus; Gossypium hirsutum; Homo sapiens; Hoya australis; Hoya bandaensis; Hoya bella; Hoya cinnamomifolia; Hoya coronaria; Hoya crassipes; Hoya diversifolia; Hoya fraterna; Hoya imperialis; Hoya lacunosa; Hoya latifolia; Hoya longifolia
COCONUT organism records56
COCONUT identifierCNP0275417.2
Source reference DOI(s)10.5962/BHL.TITLE.108605;10.1515/9783112328101-024

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

Request applicable documentation and handling information before ordering or use.