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4-[3-(Hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol

HCID 188976
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
4263-87-0
표준 SMILES
COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1O
InChIKey
KUSXBOZNRPQEON-UHFFFAOYSA-N
분자식
C20H22O6
평균 분자량
358.4 g/mol
단동위원소 질량
358.14163842

개요

5-O-Methylhierochin D has been reported in Rosa multiflora and Clematis delavayi with data available.

이름 및 식별자

우선 이름
4-[3-(Hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol
IUPAC
4-[3-(hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol
영어명
dehydrodiconiferyl alcohol
분자식
C20H22O6
분자량
358.39

이름 및 동의어

4-[3-(Hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol3-Benzofuranmethanol,2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-[(1E)-3-hydroxy-1-propenyl]-7-methoxy-, (2S,3R)-(2S)-2| cent-[4-Hydroxy-3-methoxyphenyl]-2,3-dihydro-5-[(E)-3-hydroxy-1-propenyl]-7-methoxybenzofuran-3|?-methanol4-(3-[hydroxymethyl]-5-[3-hydroxyprop-1-enyl]-7-methoxy-2,3-dihydrobenz ofuran-2-yl)-2-methoxyphenol4-[3-(hydroxymethyl)-5-(3-hydroxyprop-1-en-1-yl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoldehydrodiconiferyl alcohol3-Benzofuranmethanol, 2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxy-1-propen-1-yl)-7-methoxy-4-(3-(Hydroxymethyl)-5-(3-hydroxyprop-1-en-1-yl)-7-methoxy-2,3-dihydrobenzofuran-2-yl)-2-methoxyphenol(2S)-2α-(3-Methoxy-4-hydroxyphenyl)-5-(3-hydroxy-1-propenyl)-7-methoxy-2,3-dihydrobenzofuran-3β-methanol(2S)-2,3-Dihydro-2α-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxy-1-propenyl)-7-methoxy-3β-benzofuranmethanol4-[3-(hydroxymethyl)-5-[(E)-3-hydroxyprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol(2S)-2α-[4-Hydroxy-3-methoxyphenyl]-2,3-dihydro-5-[(E)-3-hydroxy-1-propenyl]-7-methoxybenzofuran-3β-methanol
이름 더 보기
(2S,3R)-2-(3-Methoxy-4-hydroxyphenyl)-5-[(1E)-3-hydroxy-1-propenyl]-7-methoxy-2,3-dihydrobenzofuran-3-methanol3-[[(2S)-2α-(3-Methoxy-4-hydroxyphenyl)-3β-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran]-5-yl]-2-propene-1-ol(E)-3-[[(2S)-2α-(3-Methoxy-4-hydroxyphenyl)-3β-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran]-5-yl]-2-propene-1-ol

데이터베이스 식별자

CAS
4263-87-0
PubChem CID
188976
DTXSID
DTXSID301311390

물성

구조 계산 물성

XLogP
1.9
극성 표면적
88.4 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
6
회전 가능 결합 수
6
무거운 원자 수
26
형식 전하
0
복잡도
469

물리화학적 성질

녹는점
161 · 161-162℃

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

안전 데이터

신호 어
Danger
유해·위험 문구
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H225

화학 및 산업

공급사42 곳

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上海智溯科生物科技有限公司021-58056897 15399714481 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
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추가 설명

정의ChEBI: A guaiacyl lignin obtained by cyclodimerisation of coniferol.

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