기본 정보
- CAS
469-30-7- 표준 SMILES
CC(C)=CCC1(O)C(O)=C(C(=O)CC(C)C)C(=O)C1O- InChIKey
QSHUUGSBRMSXKV-UHFFFAOYSA-N- 분자식
- C15H22O5
- 평균 분자량
- 282.33 g/mol
- 단동위원소 질량
- 282.1467238
개요
Oxyhumulinic acid is a tertiary alcohol.
이름 및 식별자
- 우선 이름
- Oxyhumulinic acid
- IUPAC
- 3,4,5-trihydroxy-2-(3-methylbutanoyl)-4-(3-methylbut-2-enyl)cyclopent-2-en-1-one
- 영어명
- 3,4,5-Trihydroxy-5-(3-methyl-2-butenyl)-2-(3-methyl-1-oxobutyl)-2-cyclopenten-1-one
- 분자량
- 0
이름 및 동의어
Oxyhumulinic acid469-30-7SCHEMBL29934449CHEBI:174702QSHUUGSBRMSXKV-UHFFFAOYSA-NDTXSID9011266842-Cyclopenten-1-one, 3,4,5-trihydroxy-2-isovaleryl-5-(3-methyl-2-butenyl)-3,4,5-trihydroxy-2-(3-methylbutanoyl)-4-(3-methylbut-2-enyl)cyclopent-2-en-1-one2-Cyclopenten-1-one, 3,4,5-trihydroxy-5-(3-methyl-2-butenyl)-2-(3-methyl-1-oxobutyl)-3,4,5-Trihydroxy-2-(3-methylbutanoyl)-5-(3-methyl-2-butenyl)-2-cyclopenten-1-one #3,4,5-Trihydroxy-2-(3-methylbutanoyl)-5-(3-methylbut-2-en-1-yl)cyclopent-2-en-1-one3,4,5-Trihydroxy-5-(3-methyl-2-buten-1-yl)-2-(3-methyl-1-oxobutyl)-2-cyclopenten-1-one
이름 더 보기
3,4,5-Trihydroxy-5-(3-methyl-2-butenyl)-2-(3-methyl-1-oxobutyl)-2-cyclopenten-1-one
3,4,5-Trihydroxy-5-(3-methyl-2-butenyl)-2-(3-methyl-1-oxobutyl)-2-cyclopenten-1-one, 9CI
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- XLogP
- 1.7
- 극성 표면적
- 94.8 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 482
관련 반응
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