Aliphatics

Methyl Linolenate

α-亚麻酸甲酯

PHY-NP-13183 · Natural product research catalog

Catalog number	PHY-NP-13183
CAS number	301-00-8
Molecular formula	C₁₉H₃₂O₂
Molecular weight	292.463 g/mol
Chemical class	Aliphatics
Main reported source	Achillea millefolium
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Methyl Linolenate 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.

IUPAC name	methyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
SMILES	CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC
InChIKey	DVWSXZIHSUZZKJ-YSTUJMKBSA-N
Subclass / scaffold	Fatty esters：Wax monoesters
PubChem CID	5319706

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

View additional properties & classification

Ring count	0
Aromatic rings	0
Fraction Csp³	0.632
Synthetic accessibility score	2.6
QED score	0.245
Lipinski rule violations	1
NPClassifier pathway	Fatty acids
NPClassifier superclass	Fatty esters
NPClassifier class	Wax monoesters
Parent SMILES	CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC
Parent formula	C₁₉H₃₂O₂
Parent molecular weight	292.463
Specified stereocenters	0
Unspecified stereocenters	0

Main reported source	Achillea millefolium
Reported source families	Asteraceae; Rosaceae; Krameriaceae

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

View occurrence records & references

LOTUS / Wikidata species	Achillea millefolium[1]; Agrimonia pilosa[1]; Anchietea pyrifolia[1]; Anchietea salutaris[1]; Azadirachta indica[1]; Bellis perennis[1]; Bidens pilosa[1]; Casimiroa greggii[1]; Coreopsis grandiflora[1]; Daphne odora[1]; Festuca arundinacea[1]; Festuca rubra[1]; Hamamelis virginiana[1]; Hedysarum polybotrys[1]; Krameria bicolor[1]
All reported source families	Asteraceae[8]; Rosaceae[3]; Krameriaceae[3]; Lamiaceae[3]; Violaceae[2]; Poaceae[2]
Genus / family records	Fragaria[1]
LOTUS species records	28
LOTUS reference records	24
COCONUT occurrence records	Achillea millefolium; Achillea nana; Aconitum napellus; Agrimonia pilosa; Anchietea pyrifolia; Anchietea salutaris; Andrographis paniculata; Annona foetida; Arabidopsis thaliana; Arnebia euchroma; Arnebia guttata; Aspergillus fumisynnematus; Astragalus bisulcatus; Azadirachta indica; Baccharoides lasiopus; Ballota limbata; Bidens pilosa; Boenninghausenia albiflora; Bothriocline ripensis; Brachyglottis bidwillii; Bupleurum chinense; Bupleurum falcatum; Bupleurum scorzonerifolium; Calea lantanoides; Calotropis gigantea; Campanula persicifolia; Carduus pycnocephalus; Casimiroa greggii; Chromolaena odorata; Chroogomphus helveticus
COCONUT organism records	117
COCONUT identifier	CNP0108916.1

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

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

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