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에리오시트린

Eriocitrin

HCID 83489
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
13463-28-0
표준 SMILES
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)c(O)c3)CC4=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChIKey
OMQADRGFMLGFJF-MNPJBKLOSA-N
분자식
C27H32O15
평균 분자량
596.5 g/mol
단동위원소 질량
596.17412031

개요

Eriocitrin is a disaccharide derivative that consists of eriodictyol substituted by a 6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. It has a role as an antioxidant. It is a member of 4'-hydroxyflavanones, a rutinoside, a trihydroxyflavanone, a member of 3'-hydroxyflavanones, a disaccharide derivative and a flavanone glycoside. It is functionally related to an eriodictyol.

이름 및 식별자

우선 이름
Eriocitrin
IUPAC
(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one
현지명
에리오시트린
영어명
ERIOCITRIN
분자식
C27H32O15
분자량
596.54

이름 및 동의어

Eriocitrin13463-28-0EriodictiosideEriodictyol-7-O-rutinosideEriodictyol 7-O-rutinosideAS293HR5XQEriodictyol 7-O-beta-rutinosideCHEBI:28709DTXSID60864408(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl)oxan-2-yl)oxy-2,3-dihydrochromen-4-one
이름 더 보기
에리오시트린C09732EriosideERIOCITRIN(SH)AkErio? EriocitrinERIOCITRIN WITH HPLCEriodictyol glycosideEriocitrin (6CI, 7CI)Eriocitrin (Standard)
RefChem:137630DTXCID7015269154H-1-Benzopyran-4-one, 7-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-5-hydroxy-, (2S)-236-668-7Eriocitrin (Mixture of Diastereomers)(S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)chroman-4-one(2S)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one(S)-7-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-5-hydroxy-4H-benzopyran-4-one

물성

구조 계산 물성

XLogP
-1.4
극성 표면적
245 Ų
수소 결합 공여자 수
9
수소 결합 수용자 수
15
회전 가능 결합 수
6
무거운 원자 수
42
형식 전하
0
복잡도
924

물리화학적 성질

녹는점
161 · 161-190°C
끓는 점
956.9 · 956.9±65.0 °C(Predicted)
밀도
1.77 · 1.77
저장 조건
2 · Inert atmosphere,2-8°C
용해도
에 용해됨DMSO (약간 용해됨), 메탄올
산도 계수 (pKa)
7.15 · 7.15±0.40(Predicted)
물리적 상태
Solid
색상
다크 베이지부터 아주 다크 베이지까지
BRN
1304401 · 1304401
InChIKey
OMQADRGFMLGFJF-BRZCIWNANA-N
SMILES
C12=C(O)C=C(O[C@H]3[C@H](O)[C@H]([C@H](O)[C@@H](CO[C@@H]4O[C@H]([C@H](O)[C@@H](O)[C@H]4O)C)O3)O)C=C1OC(C1=CC=C(O)C(O)=C1)CC2=O |&1:6,7,9,10,12,15,17,18,20,22,r|
LogP
1.47 · 1.470 (est)

화학적 성질

solid

안전 및 규제

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

안전 데이터

wgk
3
HS 번호
29389090
safety_code
22-24/25
F 고인화성물질
10-21
스토리지 클래스
13 - Non Combustible Solids

화학 및 산업

응용 분야 · 2건

개요Eriocitrin is a flavonoid originally isolated from lemon peel that has antioxidant and enzyme inhibitory activity. Eriocitrin inhibits lipid peroxidation in a cell-free assay when used at a concentration of 10 μM and enhances the effect of α-tocopherol on lipid peroxidation. It also decreases thiobarbituric acid reactive substances (TBARS) in rat plasma when administered at a dose of 75 μmol/kg, indicating a reduction in lipid peroxidation. Eriocitrin prevents acute exercise-induced increases in TBARS, Nε-(hexanoyl)lysine (HEL), o,o-dityrosine (DT), and nitrotyrosine (NT; ) in rat liver when administered at a dose of 600 mg/kg prior to exercise. It is also an inhibitor of monoamine oxidase A (MAO-A) and MAO-B (IC50s = 86.5 and 164 μM, respectively, for human recombinant receptors).

용도Eriocitrin is one of the main flavonoids in citrus limon byproduct dried powder (CBP) that exhibits antioxidant activity.

공급사100 곳

北京华美互利生物化工010-56205725 · [email protected]
成都普瑞法科技开发有限公司+86-028-82633397 18982077548 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
山西玉宁生物科技有限公司13623677056 · [email protected]
南京普怡生物科技有限公司13814510036 · [email protected]
成都埃法生物科技有限公司028-028-85142057 19983342022 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
成都市久鼎化学技术有限公司18584079237 · [email protected]

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데이터베이스 식별자

CAS
13463-28-0
PubChem CID
83489
DTXSID
DTXSID60864408
ChEMBL
CHEMBL2165586
ChEBI
CHEBI:28709
UNII
AS293HR5XQ
EC Number
236-668-7
Nikkaji
J317.894C
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四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
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上海皓之翔生物科技有限公司(原上海拓青化工有限公司)526763801 13301653310 · [email protected]
Wuhan ChemNorm Biotech Co.,Ltd.+86-27-8439 4403 18971486879 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
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上海澄绍生物科技有限公司021-61847300 13341622919 · [email protected]
上海煜柯化学品有限公司13391486464 · [email protected]

추가 설명

정의ChEBI: A disaccharide derivative that consists of eriodictyol substituted by a 6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage