Zeinoxanthin
기본 정보
- CAS
24480-38-4- 표준 SMILES
CC1=CCCC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C- InChIKey
NBZANZVJRKXVBH-NHWXEJKLSA-N- 분자식
- C40H56O
- 평균 분자량
- 552.9 g/mol
- 단동위원소 질량
- 552.43311641
개요
Zeinoxanthin is a carotenol, the structure of which is (6'R)-beta,-carotene hydroxy-substituted at C-3 with R-stereochemistry. It derives from a hydride of a (6'R)-beta,epsilon-carotene.
이름 및 식별자
- 우선 이름
- Zeinoxanthin
- IUPAC
- (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-ol
- 영어명
- (1S)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-ol
- 분자식
- C40H56O
- 분자량
- 552.87
이름 및 동의어
Zeinoxanthin3-Hydroxy-alpha-carotene(3R,6'R)-beta,epsilon-caroten-3-olJ02CU7E14HCHEBI:65244(1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-ol(1R)-3,5,5-trimethyl-4-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-((1R)-2,6,6-trimethylcyclohex-2-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl)cyclohex-3-en-1-olRefChem:93450024480-38-4Physoxanthinall-trans-Zeinoxanthin(Z)-Zeinoxanthin
이름 더 보기
α-CryptoxanthinALPHA-CRYPTOXANTHIN(3R,6'R)-α-Cryptoxanthin(3R,6'R)-β,ε-Caroten-3-olTRANS-ALPHA-CRYPTOXANTHINα-Cryptoxanthin (Standard)β,ε-Caroten-3-ol, (3R,6'R)-alpha-Cryptoxanthin >=90.0% (HPLC)(1S)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-ol
물성
구조 계산 물성
- XLogP
- 12.3
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 41
- 형식 전하
- 0
- 복잡도
- 1,240
실험 및 물리화학적 성질
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C40 isoprenoids (tetraterpenes) [PR0107]
물리화학적 성질
- 저장 조건
- -20 °C · -20°C
- 물리적 상태
- solid
- InChIKey
- NBZANZVJRKXVBH-NHWXEJKLSA-N
- SMILES
- CC(/C=C/C1=C(C)C[C@@H](O)CC1(C)C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(\C=C\[C@@H]2C(C)(C)CCC=C2C)C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- WGK 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Zeinoxanthin is an antioxidant carotenoid found in various foods such as oranges as well as in the tissues of the human eye.
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