팜애씨드

Palmitoleic Acid

HCID 445638CAS 373-49-9
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기본 정보

표준 SMILES
CCCCCC/C=C\CCCCCCCC(=O)O
InChIKey
SECPZKHBENQXJG-FPLPWBNLSA-N
분자식
C16H30O2
평균 분자량
254.41 g/mol
단동위원소 질량
254.2245802

개요

Palmitoleic acid is a hexadec-9-enoic acid in which the double bond at position C-9 has cis configuration. It has a role as an Escherichia coli metabolite, an EC 3.1.1.1 (carboxylesterase) inhibitor, a Daphnia galeata metabolite, an algal metabolite and a human blood serum metabolite. It is a conjugate acid of a palmitoleate.

이름 및 식별자

우선 이름
Palmitoleic Acid
IUPAC
(Z)-hexadec-9-enoic acid
현지명
팜애씨드
영어명
Palmitoleic acid
분자식
C16H30O2
분자량
254.41

이름 및 동의어

palmitoleic acid373-49-9(Z)-Hexadec-9-enoic acidcis-9-Hexadecenoic acid9-cis-Hexadecenoic acid(9Z)-hexadec-9-enoic acidzoomaric acidcis-Palmitoleic acidOleopalmitic acidcis-9-palmitoleic acidZoomeric acid(9Z)-Hexadecenoic acid
이름 더 보기
팜애씨드9-HEXADECENOIC ACIDC16:1PALM ACID(Z)-9-hexadecenoic acidPalmitoleicPalmitoleic Acid(PA)
9Z-hexadecenoic acidDTXSID0041197CHEBI:28716209B6YPZ4IDTXCID802119716:1(N-7)NSC-277452C16:1 trans-9

데이터베이스 식별자

CAS
373-49-9
PubChem CID
445638
DTXSID
DTXSID0041197
ChEMBL
CHEMBL453509
ChEBI
CHEBI:28716
UNII
209B6YPZ4I
EC Number
206-765-9
Nikkaji
J12.503B

물성

구조 계산 물성

XLogP
6.4
극성 표면적
37.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
13
무거운 원자 수
18

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15
Lipids · 2건

Lipids -> Unambiguous Lipids

Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Unsaturated fatty acids [FA0103]

Endocrine DisruptorsPotential endocrine disrupting compound
Melting Point-0.1 °C
Physical DescriptionLiquid
Collision Cross Section · 5건

168.4 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID0041197]

167.3 Ų [M-H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

167.95 Ų [M-H]- [CCS Type: DT; Method: stepped-field]

167.86 Ų [M-H]- [CCS Type: DT; Method: stepped-field]

167.8 Ų [M-H]-

물리화학적 성질

녹는점
0.5 °C · 0.5 °C (lit.)
끓는 점
162 °C/0.6 · 162 °C/0.6 mmHg (lit.)
밀도
0.895 g/mL · 0.895 g/mL at 20 °C (lit.)
굴절률
1.457 · 1.457-1.459
인화점
62 °C · 62 °C
저장 조건
-20 °C · -20°C
화학적 성질 · 1건

PALMITOLEIC ACID, Also called cis-9-hexa decanoic acid, formula CH3(CH2)5CH:CH(CH2)7COOH. This is an unsaturated fatty acid found in nearly every fat, especially in marine oils (15–20%). At room temperature, it is a colorless liquid. Insoluble in water; soluble in alcohol and ether. Insoluble in water; soluble in alcohol and ether. Combustible.

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 26.4% (78 of 295) of reports.

Warning

H315 (73.6%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 295 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information9-Hexadecenoic acid, (9Z)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
EPA Safer Chemical · 2건

Chemical: (Z)-9-Hexadecenoic acid

Chemical: Palmitoleic acid

Hazard Classes and CategoriesSkin Irrit. 2 (73.6%)

안전 데이터

wgk
3
ridadr
NA 1993 / PGIII
HS 번호
29161995
risk_code
36/37/38
hazard_code
Xi
safety_code
37/39-26-36

화학 및 산업

약리 정보

Tissue LocationsAdipose Tissue
Cellular LocationsExtracellular

용도 및 제조

Household ProductsInformation on 2 consumer products that contain Palmitoleic acid in the following categories is provided:
Use Classification · 4건

EPA Safer Chemical Functional Use Classes -> Surfactants

Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern

EPA Safer Chemical Functional Use Classes -> Surfactants

Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern

응용 분야 · 3건

개요Palmitoleic acid, or (Z)-9-hexadecenoic acid, is an omega - 7 mono unsaturated fatty acid with the formula CH3(CH2)5CH=CH(CH2)7COOH that is a common constituent of the glycerides of human adipose tissue. It is present in all tissues, but generally found in higher concentrations in the liver. It is biosynthesized from palmitic acid by the action of the enzyme delta-9 desaturase. A beneficial fatty acid, it has been shown to increase insulin sensitivity by suppressing inflammation, as well as inhibit the destruction of insulin-secreting pancreatic beta cells.

출처Palmitoleic acid can be abbreviated as 16:1Δ9. Dietary sources of palmitoleic acid include a variety of animal oils, vegetable oils, and marine oils. Macadamia oil (Macadamia integrifolia) and sea buckthorn oil (Hippophae rhamnoides) are botanical sources with high concentrations, containing 17 % and 40 % of palmitoleic acid, respectively.

일반 설명Palmitoleic acid is a monounsaturated fatty acid found in macadamia oil and also in blood plasma. In the human body it is produced via endogenous fat synthesis.

상·하류 제품 정보

하류 제품

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]

추가 설명

정의ChEBI: A hexadecenoic acid with a cis-double bond at position C-9.

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