Lucidumoside C
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기본 정보
- CAS
354553-73-4- 표준 SMILES
C/C=C1/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OCC(OCC)c1ccc(O)c(O)c1- InChIKey
RDLNVCALMXCDOJ-QUVQPCEGSA-N- 분자식
- C27H36O14
- 평균 분자량
- 584.6 g/mol
개요
Lucidumoside C is a secoiridoid glycoside isolated from Ligustrum lucidum which has been shown to exhibit antioxidant activity against hemolysis of red blood cells induced by free radicals. It has a role as an antioxidant, an antiviral agent and a plant metabolite. It is a beta-D-glucoside, a methyl ester, a member of pyrans, a member of catechols, a secoiridoid glycoside, a monosaccharide derivative and a monoterpene glycoside.
이름 및 식별자
- 우선 이름
- Lucidumoside C
- IUPAC
- methyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)-2-ethoxyethoxy]-2-oxoethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
- 영어명
- Lucidumoside C
- 분자식
- C27H36O14
- 분자량
- 584.57
이름 및 동의어
Lucidumoside CCHEBI:66596354553-73-4methyl (2S,3E,4S)-4-{2-[2-(3,4-dihydroxyphenyl)-2-ethoxyethoxy]-2-oxoethyl}-3-ethylidene-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylatemethyl (2S,3E,4S)-4-(2-(2-(3,4-dihydroxyphenyl)-2-ethoxyethoxy)-2-oxoethyl)-3-ethylidene-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylatemethyl (4S,5E,6S)-4-(2-(2-(3,4-dihydroxyphenyl)-2-ethoxyethoxy)-2-oxoethyl)-5-ethylidene-6-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-4H-pyran-3-carboxylatemethyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)-2-ethoxyethoxy]-2-oxoethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylateRefChem:154233orb1984106TN6939AKOS040763751Q27135211
이름 더 보기
2H-Pyran-4-acetic acid, 3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-5-(methoxycarbonyl)-, 2-(3,4-dihydroxyphenyl)-2-ethoxyethyl ester, (2S,3E,4S)-
물성
구조 계산 물성보충 중
- XLogP
- -0.7
- 극성 표면적
- 211 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 41
- 형식 전하
- 0
- 복잡도
- 937
물리화학적 성질
- 끓는 점
- 799.7 · 799.7±60.0 °C(Predicted)
- 밀도
- 1.46 · 1.46±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 9.46 · 9.46±0.10(Predicted)
관련 반응
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