기본 정보
- CAS
103476-22-8- 표준 SMILES
CCCCC/C=C\C/C=C\CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-].[Li+].[Li+].[Li+].[Li+]- InChIKey
ZWRZDPLGEFOALD-SHZILMNMSA-J- 분자식
- C39H62Li4N7O17P3S
- 평균 분자량
- 1,053.8 g/mol
- 단동위원소 질량
- 1,053.3775894
개요
See also: Linoleoyl-coa (annotation moved to).
이름 및 식별자
- 우선 이름
- Linoleoyl coenzyme A lithium salt
- IUPAC
- tetralithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(9Z,12Z)-octadeca-9,12-dienoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate
- 현지명
- 리놀레일보조효소A(C18:2)리튬염
- 영어명
- LINOLEOYL COENZYME A (C18:2) LITHIUM SALT
- 분자식
- C39H62Li4N7O17P3S
- 분자량
- 1053.7
이름 및 동의어
Linoleoyl coenzyme A lithium salt103476-22-8tetralithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(9Z,12Z)-octadeca-9,12-dienoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate리놀레일보조효소A(C18:2)리튬염linoleoyl coenzyme A (C18:2) lithiumLINOLEOYL COENZYME A (C18:2) LITHIUM SALTcoenzyme A linoleoyl derivative (C18:2), lithium salt[CIS,CIS]-9,12-OCTADECADIENOYL COENZYME A LITHIUM SALTS-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (9E,12E)-octadeca-9,12-dienethioateS-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (9Z,12Z)-octadeca-9,12-dienethioate[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(9Z,12Z)-octadeca-9,12-dienoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate
물성
구조 계산 물성
- 극성 표면적
- 400 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 22
- 회전 가능 결합 수
- 33
- 무거운 원자 수
- 71
- 형식 전하
- 0
- 복잡도
- 1,720
물리화학적 성질
- 저장 조건
- 20 °C · −20°C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- 3
화학 및 산업
응용 분야
용도Linoleoyl Coenzyme A Lithium Salt is a useful chemical research compound.
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