대마초H
Erythro-canabisine H
데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- CAS
403647-08-5- 표준 SMILES
COc1cc([C@H](O)[C@H](CO)Oc2ccc(/C=C/C(=O)NCCc3ccc(O)cc3)cc2OC)ccc1O- InChIKey
PJAFJMNWVUKNOR-MGBVTPAKSA-N- 분자식
- C28H31NO8
- 평균 분자량
- 509.5 g/mol
개요
Cannabisin H has been reported in Hibiscus with data available.
이름 및 식별자
- 우선 이름
- Erythro-canabisine H
- IUPAC
- (E)-3-[4-[(1S,2S)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide
- 현지명
- 대마초H
- 영어명
- Cannabisin H
- 분자식
- C28H31NO8
- 분자량
- 509.55
이름 및 동의어
Erythro-canabisine H403647-08-5(E)-3-[4-[(1S,2S)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide2-propenamide, 3-[4-[[(1S,2S)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl]oxy]-3-methoxyphenyl]-N-[2-(4-hydroxyphenyl)ethyl]-, (2E)-3-{4-[2-Hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-1-hydroxymethyl-ethoxy]-3-methoxy-phenyl}-N-[2-(4-hydroxy-phenyl)-ethyl]-acrylamideErythro-1-(4-hydroxy-3-methoxyphenyl)-2-{4-{2-[N-2-(4-hydroxyphenyl)ethyl]carbamoylethenyl-2-methoxyphenoxyl}}-1,3-propanodiolrel-(2E)-3-(4-{[(1R,2R)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl]oxy}-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]acrylamide(E)-3-(4-((1S,2S)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl)oxy-3-methoxyphenyl)-N-(2-(4-hydroxyphenyl)ethyl)prop-2-enamide2-propenamide, 3-(4-(((1S,2S)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl)oxy)-3-methoxyphenyl)-N-(2-(4-hydroxyphenyl)ethyl)-, (2E)-3-(4-(2-Hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-1-hydroxymethyl-ethoxy)-3-methoxy-phenyl)-N-(2-(4-hydroxy-phenyl)-ethyl)-acrylamideErythro-1-(4-hydroxy-3-methoxyphenyl)-2-(4-(2-(N-2-(4-hydroxyphenyl)ethyl)carbamoylethenyl-2-methoxyphenoxyl))-1,3-propanodiolrel-(2E)-3-(4-(((1R,2R)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl)oxy)-3-methoxyphenyl)-N-(2-(4-hydroxyphenyl)ethyl)acrylamide
이름 더 보기
데이터베이스 식별자
- CAS
403647-08-5- Nikkaji
- J1.816.541D
물성
구조 계산 물성보충 중
- XLogP
- 2.3
- 극성 표면적
- 138 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 698
물리화학적 성질
- 끓는 점
- 832.466 · 832.466±65.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.311 · 1.311±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 용해도
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 9.902 · 9.902±0.31(predicted)
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…