Ligstroside-aglycone
기본 정보
- CAS
174511-64-9- 표준 SMILES
C/C=C1/[C@H](O)OC=C(C(=O)OC)[C@H]1CC(=O)OCCc1ccc(O)cc1- InChIKey
ZJRZKUMVZLKDPM-HARHXEFRSA-N- 분자식
- C19H22O7
- 평균 분자량
- 362.4 g/mol
개요
Ligstroside-aglycone has been reported in Olea europaea with data available.
이름 및 식별자
- 우선 이름
- Ligstroside-aglycone
- IUPAC
- methyl (4S,5E,6R)-5-ethylidene-6-hydroxy-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-4H-pyran-3-carboxylate
- 영어명
- Ligustroside Aglycone
- 분자식
- C19H22O7
- 분자량
- 362.37
이름 및 동의어
Ligstroside-aglyconemethyl (4S,5E,6R)-5-ethylidene-6-hydroxy-4-(2-(2-(4-hydroxyphenyl)ethoxy)-2-oxoethyl)-4H-pyran-3-carboxylatemethyl (4S,5E,6R)-5-ethylidene-6-hydroxy-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-4H-pyran-3-carboxylateRefChem:153418Ligustroside Aglycone174511-64-9LigustrosideAglyconeDTXSID401341889(2R,3E,4S)-3-Ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-2H-pyran-4-acetic Acid 2-(4-Hydroxyphenyl)ethyl Ester; [2R-(2?,3E,4?)]-3-Ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-2H-pyran-4-acetic Acid 2-(4-Hydroxyphenyl)ethyl Ester; Ligstroside Aglycon; Ligustroside Aglycon(2R,3E,4S)-3-Ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-2H-pyran-4-acetic Acid 2-(4-Hydroxyphenyl)ethyl Ester; [2R-(2a,3E,4ss)]-3-Ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-2H-pyran-4-acetic Acid 2-(4-Hydroxyphenyl)ethyl Ester; Ligstroside Aglycon2H-Pyran-4-acetic acid, 3-ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-, 2-(4-hydroxyphenyl)ethyl ester, (2R,3E,4S)-
데이터베이스 식별자
- CAS
174511-64-9- Nikkaji
- J2.342.060K
물성
구조 계산 물성
- XLogP
- 1.5
- 극성 표면적
- 102 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 558
화학 및 산업
응용 분야
용도Ligustroside Aglycone is a natural compound that can be found in the phenolic extract of extra virgin olive oil. Studies show that extra virgin olive oil has antioxidant activity and can be used as a source of novel anti-aging phytochemicals.
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