(-)-Matairesinol

HCID 119205
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기본 정보

CAS
580-72-3
표준 SMILES
COc1cc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O)c(OC)c2)ccc1O
InChIKey
MATGKVZWFZHCLI-LSDHHAIUSA-N
분자식
C20H22O6
평균 분자량
358.4 g/mol
단동위원소 질량
358.14163842

개요

(-)-matairesinol is a lignan that is gamma-butyrolactone in which the 3 and 4 positions are substituted by 4-hydroxy-3-methoxybenzyl groups (the 3R,4R-diastereomer). It has a role as an angiogenesis inhibitor, an anti-asthmatic agent, a plant metabolite and a phytoestrogen. It is a lignan, a polyphenol and a gamma-lactone.

이름 및 식별자

우선 이름
(-)-Matairesinol
IUPAC
(3R,4R)-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
영어명
MATAIRESINOL
분자식
C20H22O6
분자량
358.39

이름 및 동의어

Matairesinol580-72-3(-)-MatairesinolArtigenin congenerMatai-resinol(3R,4R)-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-oneXLW63P8WUA3R,4R-Bis((4-hydroxy-3-methoxyphenyl)methyl)dihydro-2(3H)-furanoneDTXSID40920490CHEBI:6698FEMA NO. 4762DTXCID301349397
이름 더 보기
MatairesilMatairesionolMATAIRESINOL, >85% (HPLC)2(3H)-Furanone,dihydro-3,43,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxolanone(αR,βR)-α,β-Bis(4-hydroxy-3-methoxybenzyl)butyrolactone(3R)-3α,4β-Bis(4-hydroxy-3-methoxybenzyl)tetrahydrofuran-5-one
(3R,4R)-3,4-bis((4-hydroxy-3-methoxyphenyl)methyl)oxolan-2-oneRefChem:42458(3R,4R)-3,4-bis(4-hydroxy-3-methoxybenzyl)dihydrofuran-2(3H)-oneUNII-XLW63P8WUACHEMBL425148MEGxp0_001689ACon1_001075(8R,8'R)-(-)-Matairesinol

데이터베이스 식별자

CAS
580-72-3
PubChem CID
119205
DTXSID
DTXSID40920490
ChEMBL
CHEMBL425148
ChEBI
CHEBI:6698
UNII
XLW63P8WUA
Nikkaji
J14.221B

물성

구조 계산 물성

XLogP
3.3
극성 표면적
85.2 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
6
무거운 원자 수
26

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15
Solubility · 2건

Practically insoluble to insoluble

Sparingly Soluble (in ethanol)

Endocrine DisruptorsPotential endocrine disrupting compound
Melting Point119 °C
Physical Description · 2건

Solid

Pearl white powder, Bland aroma

물리화학적 성질

녹는점
119 · 119~120℃
끓는 점
593 · 593.0±45.0 °C(Predicted)
밀도
1.29 · 1.290±0.06 g/cm3(Predicted)
FEMA
4762 · 4762 | (-)-MATAIRESINOL
저장 조건
2 · 2-8°C
용해도
아세톤(약간), 클로로포름(약간), 메탄올(약간)에 용해됨

안전 및 규제

안전 데이터

wgk
3
safety_code
24/25
위험 등급
IRRITANT
F 고인화성물질
10-21
스토리지 클래스
11 - Combustible Solids

화학 및 산업

약리 정보

Cellular LocationsMembrane

용도 및 제조

Use Classification · 6건

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

응용 분야

용도Matairesinol is a principle plant lignan consituent of dietary fiber.

공급사88 곳

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]
南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
銘瑞集團有限公司17318633522 · [email protected]

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