Nalpha-Fmoc-L-티로신

(2S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acid

HCID 6957986

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 92954-90-0
표준 SMILES: O=C(N[C@@H](Cc1ccc(O)cc1)C(=O)O)OCC1c2ccccc2-c2ccccc21
InChIKey: SWZCTMTWRHEBIN-QFIPXVFZSA-N
분자식: C24H21NO5
평균 분자량: 403.4 g/mol
단동위원소 질량: 403.14197277

이름 및 식별자

우선 이름: (2S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acid
IUPAC: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxyphenyl)propanoic acid
현지명: Nalpha-Fmoc-L-티로신
영어명: Nalpha-Fmoc-L-tyrosine
분자식: C24H21NO5
분자량: 403.43

이름 및 동의어

(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(4-hydroxyphenyl)propanoic acid(2S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acidRefChem:397902899-551-5Fmoc-Tyr-OH92954-90-0Fmoc-L-tyrosineN-Fmoc-L-tyrosineFMOC-TYROSINEFmoc-TyrNalpha-Fmoc-L-tyrosineMFCD00134890

이름 더 보기

Nalpha-Fmoc-L-티로신FMOC-L-TYR-OHFmoc-L-TyrsineFmoc-Tyr-OH 98%

N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-tyrosine(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxyphenyl)propanoic acidN-9-FLUORENYLMETHOXYCARBONYL-L-TYROSINEM03429(((9H-Fluoren-9-yl)methoxy)carbonyl)-L-tyrosineFmoc-yrosineFmoc-L TyrosineFmoc-DL-tyrosine

데이터베이스 식별자

CAS: 92954-90-0
PubChem CID: 6957986
DTXSID: DTXSID90918847
ChEMBL: CHEMBL562672
UNII: K799958SSF
EC Number: 899-551-5
Nikkaji: J956.297D

물성

구조 계산 물성

XLogP: 4.3
극성 표면적: 95.9 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 5
회전 가능 결합 수: 7
무거운 원자 수: 30
형식 전하: 0
복잡도: 580

물리화학적 성질

녹는점: 182 · 182-187 °C
끓는 점: 672.6 · 672.6±55.0 °C(Predicted)
밀도: 1.336 · 1.336±0.06 g/cm3(Predicted)
굴절률: -22 ° · -22.0 ° (C=1, DMF)
저장 조건: 2 · 2-8°C
용해도: 메탄올에 용해됨
물리적 상태: powder to crystal
산도 계수 (pKa): 2.95 · 2.95±0.10(Predicted)
색상: 흰색에서 거의 흰색
BRN: 3573123 · 3573123
주요 응용: 펩타이드 합성
InChI: 1S/C24H21NO5/c26-16-11-9-15(10-12-16)13-22(23(27)28)25-24(29)30-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22,26H,13-14H2,(H,25,29)(H,27,28)/t22-/m0/s1
InChIKey: SWZCTMTWRHEBIN-QFIPXVFZSA-N
SMILES: OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCC2c3ccccc3-c4ccccc24

화학적 성질

Off-white powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 2924 29 70
risk_code: 36/37/38
hazard_code: Xi
safety_code: 22-24/25-36/37/39-27-26
스토리지 클래스: 13 - Non Combustible Solids

화학 및 산업

응용 분야 · 1건

용도N-Fmoc-L-tyrosine is an N-Fmoc-protected form of L-Tyrosine. L-Tyrosine is an essential amino acid that exhibits in vitro antioxidant and antiradical activities. L-Tyrosine is used as a precursor to synthesize catecholamines (e.g. Norepinephrine HCl [N674500]) in human keratinocytes, and also for the synthesis of proteins and thyroid hormones.