기본 정보
- CAS
10163-13-0- 표준 SMILES
CC1OC(OCC2OC(Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)C(O)C(O)C2O)C(O)C(O)C1O- InChIKey
IKGXIBQEEMLURG-UHFFFAOYSA-N- 분자식
- C27H30O16
- 평균 분자량
- 610.5 g/mol
- 단동위원소 질량
- 610.15338488
개요
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyl-2-oxanyl)oxymethyl]-2-oxanyl]oxy]-1-benzopyran-4-one is a glycoside and a member of flavonoids.
이름 및 식별자
- 우선 이름
- Vitamin P
- IUPAC
- 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
이름 및 동의어
Vitamin P1340-08-5CitrinRefChem:934092DTXSID001053456Solute carrier family 25, member 13Calcium-binding mitochondrial carrier protein Aralar2215-672-2OsyritinQuercetin-3-o-rutinoseDL-Rutin949926-49-2
이름 더 보기
Rutosids23502-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one10163-13-0VenorutonIlixathin1558680-22-02-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxymethyl]tetrahydropyran-2-yl]oxy-chromen-4-one
데이터베이스 식별자
- CAS
10163-13-0、1340-08-5、153-18-4- PubChem CID
- 5293655
- DTXSID
DTXSID70859300- ChEMBL
CHEMBL32579- ChEBI
CHEBI:91643- EC Number
- 215-672-2
물성
구조 계산 물성
- XLogP
- -1.3
- 극성 표면적
- 266 Ų
- 수소 결합 공여자 수
- 10
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 1,020
실험 및 물리화학적 성질
DrugsPharmaceuticals
LogP-0.09
관련 반응
3건
화합물 노트
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