5,7-Dihydroxy-3-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxy-2-(3,4,5-Trihydroxyphenyl)Chromen-4-One

HCID 5352000CAS 17912-87-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC1OC(Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O
InChIKey: DCYOADKBABEMIQ-UHFFFAOYSA-N
분자식: C21H20O12
평균 분자량: 464.4 g/mol
단동위원소 질량: 464.09547608

개요

myricitrin has been reported in Mycoacia fuscoatra, Glochidion sphaerogynum, and other organisms with data available.

이름 및 식별자

우선 이름: 5,7-Dihydroxy-3-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxy-2-(3,4,5-Trihydroxyphenyl)Chromen-4-One
IUPAC: 5,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one

이름 및 동의어

5,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-oneRefChem:1072260Myricetin 3-rhamnosideMLS000737865Rhamnoside,myricetin-3Myricetin 3-O-L-rhamnosideMyricetol 3-rhamnosideSMR0005281965,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-oneMyricetin-3-O-alpha-L-rhamnosideMyricetin 3-O-.alpha.-L-rhamnopyranosideMyricitrin (8CI)

이름 더 보기

Myricitrin [M+H]+Flavone,3,3',4',5,5',7-hexahydroxy-,3-rhamnosideCHEMBL1599224SCHEMBL13240936cid_5352000DTXSID60864807DCYOADKBABEMIQ-UHFFFAOYSA-NBDBM115130

데이터베이스 식별자

CAS: 17912-87-7
PubChem CID: 5352000
DTXSID: DTXSID60864807
ChEMBL: CHEMBL1599224

물성

구조 계산 물성

XLogP: 0.5
극성 표면적: 207 Å²
수소 결합 공여자 수: 8
수소 결합 수용자 수: 12
회전 가능 결합 수: 3
무거운 원자 수: 33
형식 전하: 0
복잡도: 760

실험 및 물리화학적 성질

Melting Point194 - 197 °C

Physical DescriptionSolid

화학 및 산업

약리 정보

Cellular LocationsCytoplasm

연결된 노트

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