기본 정보
- CAS
1460-97-5- 표준 SMILES
C=C1CC[C@H](C(C)C)[C@H]2C=C(C)CC[C@H]12- InChIKey
WRHGORWNJGOVQY-RBSFLKMASA-N- 분자식
- C15H24
- 평균 분자량
- 204.35 g/mol
- 단동위원소 질량
- 204.18780077
개요
(-)-gamma-cadinene is a member of the cadinene family of sesquiterpenes in which the isopropyl group is cis to the hydrogen at the adjacent bridgehead carbon (the 1R,4aS,8aS enantiomer). It has a role as a metabolite. It is a member of octahydronaphthalenes, a gamma-cadinene and a cadinene. It is an enantiomer of a (+)-gamma-cadinene.
이름 및 식별자
- 우선 이름
- (-)-gamma-Cadinene
- IUPAC
- (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
- 영어명
- [1R,(-)]-1,2,3,4,4aα,5,6,8aβ-Octahydro-7-methyl-4-methylene-1-isopropylnaphthalene
- 분자식
- C15H24
- 분자량
- 204.35
이름 및 동의어
(-)-gamma-cadinene1460-97-5gamma-Cadinene, (-)-2GHT32E0JU(1R,4aS,8aS)-7-methyl-4-methylidene-1-(propan-2-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthaleneCHEBI:63203(1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthaleneRefChem:67834(R)-gamma-cadinene(-)-?-CadineneNaphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-, (1alpha,4abeta,8aalpha)-UNII-2GHT32E0JU
이름 더 보기
(-)-γ-Cadinene7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene(1S,4aR,8aR)-1-isopropyl-7-methyl-4-methylene-2,3,4a,5,6,8a-hexahydro-1H-naphthaleneNaphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-, (1R,4aS,8aS)-
g-CadineneD-g-Cadinenetrans-gamma-cadinene(+)-g-CadineneRacemic gamma Cadinenetrans- .gamma.-CadineneSCHEMBL316840orb1944079
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 282
실험 및 물리화학적 성질
Boiling Point271.00 to 276.00 °C. @ 760.00 mm Hg
Physical DescriptionLiquid
물리화학적 성질
- 끓는 점
- 130 · 130-133 °C(Press: 4.3 Torr)
- 밀도
- 0.9189 g/cm3 · 0.9189 g/cm3(Temp: 24 °C)
- LogP
- 6.352 · 6.352 (est)
화학 및 산업
약리 정보
Cellular LocationsExtracellular
응용 분야
용도(-)-γ-Cadinene is a sesquiterpene and can be isolated from A. terreus. It is an antioxidant agent.
상·하류 제품 정보
하류 제품
공급사1 곳
BOC Sciences+1-631-485-4226 · [email protected]
추가 설명
정의ChEBI: A member of the cadinene family of sesquiterpenes in which the isopropyl group is cis to the hydrogen at the adjacent bridgehead carbon (the 1R,4aS,8aS enantiomer).
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