Nmda

HCID 22880CAS 6384-92-5

기본 정보

표준 SMILES: CN[C@H](CC(=O)O)C(=O)O
InChIKey: HOKKHZGPKSLGJE-GSVOUGTGSA-N
분자식: C5H9NO4
평균 분자량: 147.13 g/mol
단동위원소 질량: 147.05315777

개요

N-methyl-D-aspartic acid is an aspartic acid derivative having an N-methyl substituent and D-configuration. It has a role as a neurotransmitter agent. It is a D-alpha-amino acid, an amino dicarboxylic acid, a secondary amino compound and a D-aspartic acid derivative.

이름 및 식별자

우선 이름: Nmda
IUPAC: (2R)-2-(methylamino)butanedioic acid
영어명: N-Methyl-D-aspartic acid
분자식: C5H9NO4
분자량: 147.13

이름 및 동의어

N-methyl-D-aspartic acidNMDA6384-92-5D-Aspartic acid, N-methyl-(2R)-2-(methylamino)butanedioic acidMethyl aspartic acidN-Methyl aspartic acid2-Methylamino-succinic acidDTXSID8041082CHEBI:318821903B9Q6PIRefChem:1092483

이름 더 보기

N-Me-D-AspH-D-MEASP-OHH-N-Me-D-Asp-OHH-D-MEASP-OH HCL-D-aspartic acidN-ME-D-ASP-OH HCL

DTXCID6021082N-Methyl-D-aspartateN-Methylaspartate(R)-2-(Methylamino)succinic acidn-methyl-d-aspartic acid (nmda)N-Me-D-Asp-OHN methyl D aspartate(R)-2-Ethylbutannedioic acid

데이터베이스 식별자

CAS: 6384-92-5
PubChem CID: 22880
DTXSID: DTXSID8041082
ChEMBL: CHEMBL291278
ChEBI: CHEBI:31882
UNII: 1903B9Q6PI
Nikkaji: J246.192G

물성

구조 계산 물성

XLogP: -3.4
극성 표면적: 86.6 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 5
회전 가능 결합 수: 4
무거운 원자 수: 10
형식 전하: 0
복잡도: 145

실험 및 물리화학적 성질

CosmeticsSkin conditioning; Antistatic; Hair conditioning

Solubility>22.1 [ug/mL] (The mean of the results at pH 7.4)

Melting Point187 - 192 °C

Physical DescriptionSolid

Collision Cross Section · 2건

130 Å² [M+H]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

134.8 Å² [M+Na]+

물리화학적 성질

녹는점: 187 · 187-192 °C
끓는 점: 267.21 °C · 267.21°C (rough estimate)
밀도: 1.4285 · 1.4285 (rough estimate)
굴절률: -15 ° · -15 ° (C=2, H2O)
저장 조건: Sealed in dry,Room Temperature
용해도: 산성 수용액(약간), DMSO(약간), 물(약간)에 용해됨
물리적 상태: 고체
산도 계수 (pKa): 2.21 · 2.21±0.23(Predicted)
색상: 하얀색
수용성: 약간 용해됨
Merck: 14 · 14,6662
BRN: 1724431 · 1724431
주요 응용: 세포 분석
화장품 원료 기능: 헤어 컨디셔닝대전방지제피부 컨디셔닝
InChI: 1S/C5H9NO4/c1-6-3(5(9)10)2-4(7)8/h3,6H,2H2,1H3,(H,7,8)(H,9,10)/t3-/m1/s1
InChIKey: HOKKHZGPKSLGJE-GSVOUGTGSA-N
SMILES: CN[C@H](CC(O)=O)C(O)=O
LogP: 1.39 · 1.390 (est)

화학적 성질

white to off-white crystalline powder

안전 및 규제

안전 데이터

wgk: 3
rtecs: CI9457000
HS 번호: 29225090
safety_code: 22-24/25
F 고인화성물질: 10
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

약리 정보

Tissue LocationsBrain

Cellular LocationsCytoplasm

용도 및 제조

Use ClassificationCosmetics -> Skin conditioning; Antistatic; Hair conditioning

응용 분야 · 2건

용도NMDA(N-Methyl-D-aspartic acid)is a specific agonist for NMDA receptor mimicking the action of glutamate, the neurotransmitter which normally acts at that receptor.

일반 설명N-Methyl-D-aspartic acid (NMDA) is an endogenously generated molecule in rat nervous system and endocrine glands. NMDA is present at low level (nmol/g) in the adenohypophysis, hypothalamus, brain, and testis. NMDA is derived from D-Asp by an S-adenosylmethionine-dependent enzyme also referred to as NMDA synthase.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [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]

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

추가 설명

정의ChEBI: An aspartic acid derivative having an N-methyl substituent and D-configuration.

연결된 노트

불러오는 중…