(1R,2S)-3-oxo-2-pentyl-cyclopentaneacetic acid
기본 정보
- CAS
200059-15-0- 표준 SMILES
CCCCC[C@@H]1C(=O)CC[C@@H]1CC(=O)O- InChIKey
PQEYTAGBXNEUQL-ZJUUUORDSA-N- 분자식
- C12H20O3
- 평균 분자량
- 212.28 g/mol
개요
(-)-7-epi--9,10-dihydrojasmonic acid is a member of Jasmonate derivatives and an oxo monocarboxylic acid. It is functionally related to a jasmonic acid.
이름 및 식별자
- 우선 이름
- (1R,2S)-3-oxo-2-pentyl-cyclopentaneacetic acid
- IUPAC
- 2-[(1R,2S)-3-oxo-2-pentylcyclopentyl]acetic acid
이름 및 동의어
(-)-7-epi--9,10-dihydrojasmonic acid(1R,2S)-3-oxo-2-pentyl-cyclopentaneacetic acid7RSL8TM5GJ3GZA773UEH2-[(1R,2S)-3-oxo-2-pentylcyclopentyl]acetic acidSCHEMBL3193051CHEBI:180007PQEYTAGBXNEUQL-ZJUUUORDSA-NLMFA02020006(-)-7-epi-9,10-dihydrojasmonic acidcis-3-Oxo-2-pentylcyclopentaneacetic acid3-Oxo-2-pentylcyclopentaneacetic acid, cis-
이름 더 보기
(1R,2S)-3-Oxo-2-pentylcyclopentaneacetic acid3-Oxo-2-pentylcyclopentaneacetic acid, (1R,2S)-rel-(1R,2S)-3-Oxo-2-pentylcyclopentaneacetic acid3-Oxo-2-pentylcyclopentaneacetic acid, rel-(1R,2S)-Cyclopentaneacetic acid, 3-oxo-2-pentyl-, (1R,2S)-Cyclopentaneacetic acid, 3-oxo-2-pentyl-, (1R-cis)-(+)-(1R)-cis-3-oxo-2-pentyl-1-cyclopentaneacetic acidCyclopentaneacetic acid, 3-oxo-2-pentyl-, (1R,2S)-rel-
데이터베이스 식별자
- CAS
200059-15-0、96844-45-0- PubChem CID
- 9920768
- ChEBI
CHEBI:180007- UNII
- 3GZA773UEH、7RSL8TM5GJ
- Nikkaji
- J943.750I
물성
구조 계산 물성
- XLogP
- 2.3
- 극성 표면적
- 54.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 235
실험 및 물리화학적 성질
LipidsFatty Acyls [FA] -> Octadecanoids [FA02] -> Jasmonic acids [FA0202]
관련 반응
1건
화합물 노트
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