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캡사이신(E/Z-혼합물)

N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methylnon-6-enamide

HCID 2548
노트반응
기본 정보개요이름 및 식별자물성화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
7553-53-9
표준 SMILES
COc1cc(CNC(=O)CCCCC=CC(C)C)ccc1O
InChIKey
YKPUWZUDDOIDPM-UHFFFAOYSA-N
분자식
C18H27NO3
평균 분자량
305.4 g/mol
단동위원소 질량
305.19909372

개요

N-[(4-Hydroxy-3-methoxyphenyl)methyl]-8-methyl-6-nonenamide has been reported in Capsicum pubescens, Capsicum annuum, and Capsicum with data available.

이름 및 식별자

우선 이름
N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methylnon-6-enamide
IUPAC
N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide
현지명
캡사이신(E/Z-혼합물)
영어명
Capsaicin (E/Z-Mixture)
분자식
C18H27NO3
분자량
305.41

이름 및 동의어

N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide7553-53-9DTXSID40859357N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methylnon-6-enamideRefChem:1090695DTXCID60809718CAPSAICIN, NATURALN-[(4-Hydroxy-3-methoxyphenyl)methyl]-8-methyl-6-nonenamide6-Nonenamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl-, (6Z)-Zucapsaicin;Civamide;cis-CapsaicinMFCD000172598-Methyl-N-vanillyl-trans-6-nonenamide
이름 더 보기
캡사이신(E/Z-혼합물)(E/Z)-8-Methyl-N-vanillyl-6-nonenaMideN-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide6-Nonenamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl-Capsaicin-D3 (E/Z-Mixture)Q: What is Capsaicin-D3 (E/Z-Mixture) Q: What is the CAS Number of Capsaicin-D3 (E/Z-Mixture) Q: What is the storage condition of Capsaicin-D3 (E/Z-Mixture) Q: What are the applications of Capsaicin-D3 (E/Z-Mixture)
Capsaicin(Vanilloid)Spectrum_000303Prestwick0_000879Prestwick1_000879Spectrum2_000770Spectrum3_001449Spectrum4_001739Capsaicin (E/Z-Mixture)

물성

구조 계산 물성

XLogP
3.6
극성 표면적
58.6 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
3
회전 가능 결합 수
9
무거운 원자 수
22
형식 전하
0
복잡도
341

물리화학적 성질

녹는점
60 · 60-620C
끓는 점
511.5 · 511.5±50.0 °C(Predicted)
밀도
1.041 · 1.041±0.06 g/cm3(Predicted)
저장 조건
-20 °C · -20°C Freezer, Under Inert Atmosphere
산도 계수 (pKa)
9.76 · 9.76±0.20(Predicted)

화학적 성질

Capsaicin(E/Z-Mixture) is Off-White Solid

화학 및 산업

응용 분야

용도Capsaicin(E/Z-Mixture) is a representative lot is a 5:1 E:Z mixture. Has been isolated from paprika and cayenne. It is used as a tool in neurobiological research. Prototype vanilloid receptor agonist. Topical analgesic.

공급사5 곳

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

관련 반응

3건
반응 기록 만들기
HRID 942851 반응식
HRID 942851반응물로Validation data from https://doi.org/10.1039/C8SC04228D
HRID 1222498 반응식
HRID 1222498반응물로Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1228105 반응식
HRID 1228105반응물로Training data from https://doi.org/10.1039/C8SC04228D (5/10)

화합물 노트

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이 페이지에서기본 정보개요이름 및 식별자물성화학 및 산업관련 반응화합물 노트

데이터베이스 식별자

CAS
7553-53-9
PubChem CID
2548
DTXSID
DTXSID40859357
ChEMBL
CHEMBL3187928