기본 정보
- CAS
1107-26-2- 표준 SMILES
CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)CCC1- InChIKey
DFMMVLFMMAQXHZ-DOKBYWHISA-N- 분자식
- C30H40O
- 평균 분자량
- 416.6 g/mol
- 단동위원소 질량
- 416.3079159
개요
8'-apo-beta,psi-caroten-8'-al is an apo carotenoid triterpenoid compound arising from oxidative degradation of the beta,beta-carotene skeleton at the 8'-position. It is an apo carotenoid triterpenoid and an enal.
이름 및 식별자
- 우선 이름
- beta-apo-8'-CAROTENAL
- IUPAC
- (2E,4E,6E,8E,10E,12E,14E,16E)-2,6,11,15-tetramethyl-17-(2,6,6-trimethylcyclohexen-1-yl)heptadeca-2,4,6,8,10,12,14,16-octaenal
- 영어명
- All-trans-beta-apo-8'-carotenal
- 분자식
- C30H40O
- 분자량
- 416.638
이름 및 동의어
Apocarotenal1107-26-2beta-apo-8'-carotenal8'-Apo-beta-carotenalC.I. Food Orange 6beta-apo-Carotenalbeta-ApocarotenalC Orange 16Food orange 68'Apo-beta,psi-carotenalall-trans-beta-Apo-8'-carotenal(2E,4E,6E,8E,10E,12E,14E,16E)-2,6,11,15-tetramethyl-17-(2,6,6-trimethylcyclohexen-1-yl)heptadeca-2,4,6,8,10,12,14,16-octaenal
이름 더 보기
8'-Apo-beta-carotenal, all-trans-
8'-Apo-beta,psi-carotenalCI 40820DTXSID20883251V22N3E2U322,4,6,8,10,12,14,16-Heptadecaoctaenal, 2,6,11,15-tetramethyl-17-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (2E,4E,6E,8E,10E,12E,14E,16E)-2,4,6,8,10,12,14,16-Heptadecaoctaenal, 2,6,11,15-tetramethyl-17-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all-E)-12676-20-9RefChem:113474
데이터베이스 식별자
- CAS
1107-26-2、12676-20-9- PubChem CID
- 5478003
- DTXSID
DTXSID20883251- ChEBI
CHEBI:53154
물성
구조 계산 물성
- XLogP
- 9.4
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 887
실험 및 물리화학적 성질
CosmeticsCosmetic colorant
Food Additives
Foods -> FDA Regulatory Status of Color Additives
COLOR OR COLORING ADJUNCT -> FDA Substance added to food
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 96.3% (131 of 136) of all reports.
Not Classified
Aggregated GHS information provided per 136 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: 8'-Apo-.beta.,.pseudo.-carotenal
Regulation (EC) No 178/2002 (amended)
2,4,6,8,10,12,14,16-Heptadecaoctaenal, 2,6,11,15-tetramethyl-17-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (2E,4E,6E,8E,10E,12E,14E,16E)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
화학 및 산업
용도 및 제조
Use Classification
Food Additives -> COLOUR -> JECFA Functional Classes
Cosmetics -> Cosmetic colorant
General Manufacturing Information2,4,6,8,10,12,14,16-Heptadecaoctaenal, 2,6,11,15-tetramethyl-17-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (2E,4E,6E,8E,10E,12E,14E,16E)-: ACTIVE
공급사83 곳
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
銘瑞集團有限公司17318633522 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海钰博生物科技有限公司021-60514606 18321282235 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
江苏星科元信息科技有限公司400-605-7200 15335295587 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
上海纽雀客生物科技有限公司13916276291 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
관련 반응
1건
화합물 노트
불러오는 중…