Methyl-6,9,12,15,18-heneicosapentaenoate

Compound Structure:

Synonyms:

Methyl (6Z,9Z,12Z,15Z,18Z)-henicosa-6,9,12,15,18-pentaenoate; (all-Z)-6,9,12,15,18-Heneicosapentaenoic Acid Methyl Ester; Heneicosapentaenoic acid methyl ester; (6Z,9Z,12Z,15Z,18Z)-6,9,12,15,18-Heneicosapentaenoic Acid Methyl Ester;

Compound ID:

NMPC-1265

PubChem ID:

90382235

Molecular Formula:

C22H34O2

Canonical SMILES:

CCC=CCC=CCC=CCC=CCC=CCCCCC(=O)OC

InChIKey:

VWHAHPVYEMPWTO-JEBPEJKESA-N

About the compound:

Properties:

Chemical and Physical Properties

Computed Properties

Property Name	Property Value
Molecular Weight	330.5 g/mol
XLogP3-AA	6.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	15
Exact Mass	330.255880323 g/mol
Monoisotopic Mass	330.255880323 g/mol
Topological Polar Surface Area	26.3Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	425
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	5
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Dalbergia saxatilis

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