홈MCP워크벤치Skills
홈워크벤치알림마이페이지
Huagongshe 오픈 프로젝트:[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.8
  1. 홈
  2. /화합물

2-(4-(Bis(carboxymethyl)amino)-3-(2-(2-(bis(carboxymethyl)amino)-5-methylphenoxy)ethoxy)phenyl)-1H-indole-6-carboxylic acid

HCID 105060
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
96314-96-4
표준 SMILES
Cc1ccc(N(CC(=O)O)CC(=O)O)c(OCCOc2cc(-c3cc4ccc(C(=O)O)cc4[nH]3)ccc2N(CC(=O)O)CC(=O)O)c1
InChIKey
AMHAQOBUZCQMHN-UHFFFAOYSA-N
분자식
C32H31N3O12
평균 분자량
649.6 g/mol
단동위원소 질량
649.19077343

개요

Indo-1 dye is a member of indoles. It has a role as a fluorochrome.

이름 및 식별자

우선 이름
2-(4-(Bis(carboxymethyl)amino)-3-(2-(2-(bis(carboxymethyl)amino)-5-methylphenoxy)ethoxy)phenyl)-1H-indole-6-carboxylic acid
IUPAC
2-[4-[bis(carboxymethyl)amino]-3-[2-[2-[bis(carboxymethyl)amino]-5-methylphenoxy]ethoxy]phenyl]-1H-indole-6-carboxylic acid
영어명
INDO 1 PENTAPOTASSIUM SALT
분자식
C32H31N3O12
분자량
649.6

이름 및 동의어

Indo 1Indo-196314-96-4N18RMK75W12-(4-(Bis(carboxymethyl)amino)-3-(2-(2-(bis(carboxymethyl)amino)-5-methylphenoxy)ethoxy)phenyl)-1H-indole-6-carboxylic acid2-[4-[bis(carboxymethyl)amino]-3-[2-[2-[bis(carboxymethyl)amino]-5-methylphenoxy]ethoxy]phenyl]-1H-indole-6-carboxylic acidDTXSID602422021H-Indole-6-carboxylic acid, 2-(4-(bis(carboxymethyl)amino)-3-(2-(2-(bis(carboxymethyl)amino)-5-methylphenoxy)ethoxy)phenyl)-2-{4-[bis(carboxymethyl)amino]-3-(2-{2-[bis(carboxymethyl)amino]-5-methylphenoxy}ethoxy)phenyl}-1H-indole-6-carboxylic acidRefChem:909295DTXCID20164693Indo-1 (sodium salt)
이름 더 보기
INDO 1, FOR FLUORESCENCEINDO 1 PENTAPOTASSIUM SALTAMHAQOBUZCQMHN-UHFFFAOYSA-NINDO 1 PENTASODIUM SALT >95% FLUORESCENT MARKER FO4-(6-CARBOXY-2-INDOLYL)-4'-METHYL-2,2-(ETHYLENEDIOXY)DIANILINE-N,N,N',N'-TETRAACETIC ACID PENTAPOTASSIUM SALT4-(6-carboxy-2-indolyl)-4'-methyl-2,2'-(ethylenedioxy)dianiline-n,n,n',n'-tetraacetic acid pentapotassium salt

물성

구조 계산 물성

XLogP
3.9
극성 표면적
227 Ų
수소 결합 공여자 수
6
수소 결합 수용자 수
14
회전 가능 결합 수
17
무거운 원자 수
47
형식 전하
0
복잡도
1,090

물리화학적 성질

끓는 점
1016.3 · 1016.3±65.0 °C(Predicted)
밀도
1.527 · 1.527±0.06 g/cm3(Predicted)
저장 조건
20 °C · −20°C
산도 계수 (pKa)
1 · pKa1: 6.2; pKa2: 4.35(at 25℃)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

안전 데이터

wgk
3
safety_code
22-24/25
F 고인화성물질
8-10-23

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

Chemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS.

Chemicals that emit light after excitation by light. The wave length of the emitted light is usually longer than that of the incident light. Fluorochromes are substances that cause fluorescence in other substances, i.e., dyes used to mark or label other compounds with fluorescent tags.

응용 분야

용도Indo-1, pentapotassium salt is a fluorescent calcium chelator and indicator with an unusually large shift in fluorescence emission from 480 nm to 400 nm on binding of calcium. Useful for intracellular application.

공급사2 곳

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]

관련 반응

1건
반응 기록 만들기
HRID 1742753 반응식
HRID 1742753생성물로uspto-grants-1994_08

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
1-[2-Amino-5-(6-carboxy-2-indolyl)phenoxy]-2-(2-amino-5-methylphenoxy)-ethane-N,N,N',N'-tetraaceticacid,pentapotassiumsalt
2,2'-((2-(2-(2-(Bis(carboxymethyl)amino)-5-(6-carboxy-1H-indol-2-yl)phenoxy)ethoxy)-4-methylphenyl)azanediyl)diacetic acidUNII-N18RMK75W1Indo-1 dyestarbld0013467INDO-1 [MI]orb3132844SCHEMBL4079001CHEMBL1205006

데이터베이스 식별자

CAS
96314-96-4
PubChem CID
105060
DTXSID
DTXSID60242202
ChEMBL
CHEMBL1205006
ChEBI
CHEBI:52084
UNII
N18RMK75W1
Nikkaji
J227.913D