기본 정보
- CAS
64332-37-2- 표준 SMILES
C=CC[C@]1([C@H](C)[C@@H](O)c2cc(OC)c(OC)c(OC)c2)C[C@@H](OC)C=CC1=O- InChIKey
JCRROBQLLRCCAV-SQKDIAQBSA-N- 분자식
- C22H30O6
- 평균 분자량
- 390.5 g/mol
- 단동위원소 질량
- 390.20423867
개요
Megaphone is an aliphatic alcohol.
이름 및 식별자
- 우선 이름
- (4R,6R)-6-((1S,2R)-2-Hydroxy-1-methyl-2-(3,4,5-trimethoxyphenyl)ethyl)-4-methoxy-6-(2-propen-1-yl)-2-cyclohexen-1-one
- IUPAC
- (4R,6R)-6-[(1R,2S)-1-hydroxy-1-(3,4,5-trimethoxyphenyl)propan-2-yl]-4-methoxy-6-prop-2-enylcyclohex-2-en-1-one
이름 및 동의어
Megaphone64332-37-2NSC-2884088J0BV7D5N9Cytotoxic neolignan from aniba megaphylla(4R,6R)-6-[(1R,2S)-1-hydroxy-1-(3,4,5-trimethoxyphenyl)propan-2-yl]-4-methoxy-6-prop-2-enylcyclohex-2-en-1-one2-Cyclohexen-1-one, 6-((1S,2R)-2-hydroxy-1-methyl-2-(3,4,5-trimethoxyphenyl)ethyl)-4-methoxy-6-(2-propen-1-yl)-, (4R,6R)-DTXSID80214542(4R,6R)-6-((1R,2S)-1-hydroxy-1-(3,4,5-trimethoxyphenyl)propan-2-yl)-4-methoxy-6-prop-2-enylcyclohex-2-en-1-one(4R,6R)-6-allyl-6-((1S,2R)-2-hydroxy-1-methyl-2-(3,4,5-trimethoxyphenyl)ethyl)-4-methoxy-cyclohex-2-en-1-one(4R,6R)-6-allyl-6-[(1S,2R)-2-hydroxy-1-methyl-2-(3,4,5-trimethoxyphenyl)ethyl]-4-methoxy-cyclohex-2-en-1-oneRefChem:1050506
이름 더 보기
DTXCID10137033(4R,6R)-6-((1S,2R)-2-Hydroxy-1-methyl-2-(3,4,5-trimethoxyphenyl)ethyl)-4-methoxy-6-(2-propen-1-yl)-2-cyclohexen-1-one(-)-MegaphoneUNII-8J0BV7D5N9Megaphone (molecule)AC1L9DMECHEBI:6720Q6808812
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 74.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 547
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