팔미틴산레티놀

Retinol Palmitate

HCID 5280531
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기본 정보

CAS
79-81-2
표준 SMILES
CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C
InChIKey
VYGQUTWHTHXGQB-FFHKNEKCSA-N
분자식
C36H60O2
평균 분자량
524.9 g/mol
단동위원소 질량
524.45933116

개요

All-trans-retinyl palmitate is an all-trans-retinyl ester obtained by formal condensation of the carboxy group of palmitic (hexadecanoic acid) with the hydroxy group of all-trans-retinol. It is used in cosmetic products to treat various skin disorders such as acne, skin aging, wrinkles, dark spots, and also protect against psoriasis. It has a role as an antioxidant, a human xenobiotic metabolite and an Escherichia coli metabolite. It is a retinyl palmitate and an all-trans-retinyl ester. It is functionally related to an all-trans-retinol.

이름 및 식별자

우선 이름
Retinol Palmitate
IUPAC
[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate
현지명
팔미틴산레티놀
영어명
Vitamin A palmitate
분자식
C36H60O2
분자량
524.86

이름 및 동의어

retinyl palmitateVITAMIN A PALMITATE79-81-2Retinol palmitateRetinol, hexadecanoateall-trans-Retinyl palmitateArovitOptovit-ARetinyl hexadecanoateVitamin A SolubilizedDTXSID1021241[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate
이름 더 보기
팔미틴산레티놀비타민A팔미테이트레티닐팔미테이트Vitamin a Palmitate OilVitamin A Palmitate PowderVITAMIN A PALMITATE 1.7 MIUVitaminAPalmitateinOilDry Vitamin A PalmitateHelianthus Annuus Seed OilRetinylpalmitatVITAMIN A PALMITATE Liquid
1D1K0N0VVCNSC-758478Retinol, palmitate, all-transAll-(e)-retinol palmitateDTXCID101241CHEBI:17616Vitamin a palmitate (solubilized)Retinol Hexadecanoate

데이터베이스 식별자

CAS
79-81-2
PubChem CID
5280531
DTXSID
DTXSID1021241
ChEMBL
CHEMBL1675
ChEBI
CHEBI:17616
UNII
1D1K0N0VVC
EC Number
201-228-5
Nikkaji
J3.849K

물성

구조 계산 물성

XLogP
13.6
극성 표면적
26.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
21
무거운 원자 수
38

실험 및 물리화학적 성질

LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> Retinoids [PR0109]
Cosmetics · 2건

Cosmetic ingredients (Retinyl Palmitate) -> CIR (Cosmetic Ingredient Review)

Skin conditioning

Food AdditivesCOLOR OR COLORING ADJUNCT, NUTRIENT SUPPLEMENT -> FDA Substance added to food
Human Drugs · 2건

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Melting Point28.5 °C
Physical DescriptionSolid

물리화학적 성질

녹는점
28 · 28-29℃
끓는 점
546.51 °C · 546.51°C (rough estimate)
밀도
0.9668 · 0.9668 (rough estimate)
굴절률
1.525 · 1.5250 (estimate)
인화점
194 ℃ · 194℃
저장 조건
2 · 2-8°C

화학적 성질

95.0-100.5% Absorbance @325 nm ≥0.85%

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 8.4% (54 of 643) of reports.

Danger

H315 (19%): Causes skin irritation [Warning Skin corrosion/irritation]

P203, P264, P273, P280, P302+P352, P318, P321, P332+P317, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 643 reports by companies from 30 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Retinol, hexadecanoate

Regulation (EC) No 1831/2003 (amended)

Status: Active Update: 13-03-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/13687

Retinyl palmitate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (19%)

독성 정보

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
Drug Induced Liver Injury · 6건

Drug Induced Liver Injury Rank (DILIrank 2.0)

Vitamin A palmitate

vLess-DILI-concern

3

Warnings & precautions

DOI:10.1016/j.drudis.2016.02.015

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
VH6860000
ridadr
UN1170 - class 3 - PG 2 - Ethanol, solution
독성
LD50 (10 day) in mice, rats (mg/kg): 6060, 7910 orally (Kamm)
HS 번호
29362100

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

Naturally occurring or synthetic substances that inhibit or retard oxidation reactions. They counteract the damaging effects of oxidation in animal tissues.

Agents that reduce the frequency or rate of spontaneous or induced tumors independently of the mechanism involved.

Tissue LocationsAdipose Tissue
Cellular LocationsExtracellular
Metabolite PathwaysRetinol Metabolism

용도 및 제조

UsesCIR ingredient: Retinyl Palmitate
Household ProductsInformation on 131 consumer products that contain Retinyl palmitate in the following categories is provided:
Use ClassificationCosmetics -> Skin conditioning
General Manufacturing InformationRetinol, hexadecanoate: ACTIVE
응용 분야 · 2건

용도vitamin A palmitate is known as a skin “normalizer.” It acts as an antikeratinizing agent, helping the skin stay soft and plump, and improving its water-barrier properties. Because of its impact on the skin’s water-barrier properties, it is useful against dryness, heat, and pollution. It is also an anti-oxidant and is suggested for use in sunscreens. Clinical studies with vitamin A palmitate indicate a significant change in skin composition, with increases in collagen, DnA, skin thickness, and elasticity. Vitamin A palmitate’s stability is superior to retinol.

일반 설명Certified pharmaceutical secondary standards for application in quality control provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to pharmacopeia primary standards.Retinyl palmitate belongs to a category of compounds called retinoids, which are chemically similar to vitamin A. It exhibits a beneficial effect on vision, skin and immune function, inhibits cell proliferation and prevents cancer. It is an important dietary as well as a therapeutic compound.

상·하류 제품 정보

공급사100 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]

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