기본 정보
- CAS
130756-21-7- 표준 SMILES
COc1ccc(C2CC(=O)c3c(cc(O)c(CC=C(C)C)c3O)O2)c(CC=C(C)C)c1O- InChIKey
HHUBHYQGRICPOK-UHFFFAOYSA-N- 분자식
- C26H30O6
- 평균 분자량
- 438.5 g/mol
- 단동위원소 질량
- 438.20423867
이름 및 식별자
- 우선 이름
- 5,7-Dihydroxy-2-(3-hydroxy-4-methoxy-2-(3-methyl-but-2-enyl)-phenyl)-6-((E)-3-methyl-but-2-enyl)-1-benzopyran-4-one
- IUPAC
- 5,7-dihydroxy-2-[3-hydroxy-4-methoxy-2-(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
이름 및 동의어
Antiarone H130756-21-75,7-Dihydroxy-2-(3-hydroxy-4-methoxy-2-(3-methyl-but-2-enyl)-phenyl)-6-((E)-3-methyl-but-2-enyl)-1-benzopyran-4-one5,7-Dihydroxy-2-[3-hydroxy-4-methoxy-2-(3-methyl-but-2-enyl)-phenyl]-6-((E)-3-methyl-but-2-enyl)-1-benzopyran-4-oneRefChem:298833DTXSID609268935,7-Dihydroxy-2-[3-hydroxy-4-methoxy-2-(3-methylbut-2-en-1-yl)phenyl]-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-1-benzopyran-4-one5,7-dihydroxy-2-[3-hydroxy-4-methoxy-2-(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)chroman-4-one
데이터베이스 식별자
- CAS
130756-21-7- PubChem CID
- 480773
- DTXSID
DTXSID60926893
물성
구조 계산 물성
- XLogP
- 6.2
- 극성 표면적
- 96.2 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 707
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…