기본 정보
- CAS
98569-62-1- 표준 SMILES
COc1c(C)c(O)c(C(C)=O)c(O)c1Cc1c(O)c2c(c(C(C)=O)c1O)OC(C)(C)C=C2- InChIKey
DIXWVWLWNGDQEC-UHFFFAOYSA-N- 분자식
- C24H26O8
- 평균 분자량
- 442.5 g/mol
- 단동위원소 질량
- 442.16276778
개요
Mallotochromene is a 1-benzopyran.
이름 및 식별자
- 우선 이름
- Mallotochromene
- IUPAC
- 1-[3-[(8-acetyl-5,7-dihydroxy-2,2-dimethylchromen-6-yl)methyl]-2,6-dihydroxy-4-methoxy-5-methylphenyl]ethanone
- 현지명
- 말로토크로멘
- 영어명
- mallotochromene
- 분자식
- C24H26O8
- 분자량
- 442.45844
이름 및 동의어
Mallotochromene98569-62-18-Acetyl-5,7-dihydroxy-6-(3-acetyl-2,4-dihydroxy-5-methyl-6-methoxybenzyl)-2,2-dimethylchromene8Q7ZTX539BDTXSID602437191-[3-[(8-acetyl-5,7-dihydroxy-2,2-dimethylchromen-6-yl)methyl]-2,6-dihydroxy-4-methoxy-5-methylphenyl]ethanoneEthanone, 1-(3-((8-acetyl-5,7-dihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)methyl)-2,6-dihydroxy-4-methoxy-5-methylphenyl)-1-(3-((8-acetyl-5,7-dihydroxy-2,2-dimethylchromen-6-yl)methyl)-2,6-dihydroxy-4-methoxy-5-methylphenyl)ethanoneEthanone, 1-[3-[(8-acetyl-5,7-dihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)methyl]-2,6-dihydroxy-4-methoxy-5-methylphenyl]-RefChem:155426DTXCID40166210CHEMBL521361
이름 더 보기
말로토크로멘8-Acetyl-6-(3-acetyl-2,4-dihydroxy-6-methoxy-5-methylphenyl)methyl-2,2-dimethyl-α-chromene-5,7-diol1-[3-[(8-Acetyl-5,7-dihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)methyl]-2,6-dihydroxy-4-methoxy-5-methylphenyl]ethanone
AC1L2R8IAC1Q5D3UUNII-8Q7ZTX539BCHEBI:6656SCHEMBL30616016C09013Q154262051-(3-((8-ACETYL-5,7-DIHYDROXY-2,2-DIMETHYL-2H-1-BENZOPYRAN-6-YL)METHYL)-2,6-DIHYDROXY-4-METHOXY-5-METHYLPHENYL)ETHANONE
물성
구조 계산 물성
- XLogP
- 4.2
- 극성 표면적
- 134 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 748
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