HEPTADECENOIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H32O2
Molecular Weight	268.4348
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCC\C=C/CCCCCCCCC(O)=O

InChI

InChIKey=GDTXICBNEOEPAZ-FPLPWBNLSA-N

InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h7-8H,2-6,9-16H2,1H3,(H,18,19)/b8-7-

HIDE SMILES / InChI

Molecular Formula	C17H32O2
Molecular Weight	268.4348
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/18827358 | https://www.ncbi.nlm.nih.gov/pubmed/16357280

Heptadecenoic acid is a monounsaturated fatty acid. Heptadecenoic acid (17:1) is a minor constituent of ruminant fats. It has possible antitumor activity. Heptadecenoic acid is used in lipid studies and biological systems.

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
HL-60 8 Target ID: CHEMBL383 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18827358	Inhibitor 8297		302.0 µM [IC50]
Streptococcus sobrinus 1 Target ID: CHEMBL612316 Sources: https://www.ncbi.nlm.nih.gov/pubmed/9028262	Inhibitor 8297

Conditions

Condition	Modality	Targets	Highest Phase	Product
Cancer 592 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18827358	Primary		Basic research	Unknown Approved Use Unknown
Streptococcus sobrinus oral infection 1 Sources: https://www.ncbi.nlm.nih.gov/pubmed/9028262	Primary		Basic research	Unknown Approved Use Unknown

PubMed

Title	Date	PubMed

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Heptadecenoic acid inhibits HL-60 cells growth with IC50 value 302 uM.

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:36:40 GMT 2023` Edited by `admin` on `Fri Dec 15 19:36:40 GMT 2023`
Record UNII	H8A6DO053E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HEPTADECENOIC ACID

Systematic Name

English

(Z)-HEPTADEC-10-ENOIC ACID

Systematic Name

English

CIS-10-HEPTADECENOIC ACID

Systematic Name

English

(10Z)-10-HEPTADECENOIC ACID

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C68392