기본 정보
- CAS
38574-31-1- 표준 SMILES
CC(C)=CCC1(CC=C(C)C)C(=O)C(O)=C(C(=O)CC(C)C)C1=O- InChIKey
YDAFVJGIRJZGKB-UHFFFAOYSA-N- 분자식
- C20H28O4
- 평균 분자량
- 332.4 g/mol
개요
hulupone has been reported in Humulus lupulus with data available.
이름 및 식별자
- 우선 이름
- Hulupone
- IUPAC
- 4-hydroxy-5-(3-methylbutanoyl)-2,2-bis(3-methylbut-2-enyl)cyclopent-4-ene-1,3-dione
- 영어명
- 4-Hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-4-cyclopentene-1,3-dione
- 분자량
- 0
이름 및 동의어
HuluponeHulupone-HT8M51P7PV468-62-2UNII-HT8M51P7PV4-hydroxy-5-(3-methylbutanoyl)-2,2-bis(3-methylbut-2-enyl)cyclopent-4-ene-1,3-dione1,2,4-Cyclopentanetrione, 5-isovaleryl-3,3-bis(3-methyl-2-butenyl)-1,2,4-Cyclopentanetrione, 3,3-bis(3-methyl-2-buten-1-yl)-5-(3-methyl-1-oxobutyl)-3,3-Bis(3-methyl-2-buten-1-yl)-5-(3-methyl-1-oxobutyl)-1,2,4-cyclopentanetrione4-hydroxy-2,2-bis(3-methylbut-2-en-1-yl)-5-(3-methylbutanoyl)cyclopent-4-ene-1,3-dioneRefChem:1468921,2,4-Cyclopentanetrione, 3,3-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-
이름 더 보기
4-Hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-4-cyclopentene-1,3-dione4-Cyclopentene-1,3-dione, 4-hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-
1,3-Cyclopentanedione, 4-hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-SGJIYESRGDTFSD-UHFFFAOYSA-NSCHEMBL29351523YDAFVJGIRJZGKB-UHFFFAOYSA-N4-Hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-cyclopent-4-en-1,3-dioneQ278964484-Hydroxy-5-(3-methylbutanoyl)-2,2-bis(3-methyl-2-butenyl)-4-cyclopentene-1,3-dione #Cyclopent-4-ene-1,3-dione, 4-Hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-
물성
구조 계산 물성
- XLogP
- 5.3
- 극성 표면적
- 71.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 617
화학 및 산업
약리 정보
Cellular LocationsExtracellular
관련 반응
0건
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