Chem
J-GLOBAL ID：200907050078353004
Nikkaji number：J1.528.590G
(4R,6R)-5,5-Dimethyl-4,6-dimethoxy-7-(p-tolylthio)-1-heptene
(4R,6R)-5,5-ジメチル-4,6-ジメトキシ-7-(p-トリルチオ)-1-ヘプテン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C18H28O2S
Molecular formula furigana： C18-H28-O2-S
Molecular weight： 308.480
InChI：
InChI=1S/C18H28O2S/c1-7-8-16(19-5)18(3,4)17(20-6)13-21-15-11-9-14(2)10-12-15/h7,9-12,16-17H,1,8,13H2,2-6H3/t16-,17+/m1/s1
InChI key：
ZNSSDQJTDAIXCF-SJORKVTESA-N
SMILES：
CO[C@@H](CSc1ccc(C)cc1)C(C)(C)[C@@H](CC=C)OC
Systematic name (4)：
- (4R,6R)-4,6-ジメトキシ-5,5-ジメチル-7-(4-メチルフェニルチオ)-1-ヘプテン
- (4R,6R)-5,5-ジメチル-4,6-ジメトキシ-7-(p-トリルチオ)-1-ヘプテン
- 1-{[(2R,4R)-2,4-ジメトキシ-3,3-ジメチルヘプタ-6-エン-1-イル]スルファニル}-4-メチルベンゼン
- 1-{[(2R,4R)-2,4-dimethoxy-3,3-dimethylhept-6-en-1-yl]sulfanyl}-4-methylbenzene
- (4R,6R)-4,6-Dimethoxy-5,5-dimethyl-7-(4-methylphenylthio)-1-heptene
- (4R,6R)-5,5-Dimethyl-4,6-dimethoxy-7-(p-tolylthio)-1-heptene
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