Chem
J-GLOBAL ID：200907063473507945
Nikkaji number：J1.826.502H
(1R,3E,7E,13S)-4,8,13,16,16-Pentamethyl-12-oxatricyclo[8.5.2.013,17]heptadecane-3,7,10-triene
(1R,3E,7E,13S)-4,8,13,16,16-ペンタメチル-12-オキサトリシクロ[8.5.2.013,17]ヘプタデカン-3,7,10-トリエン
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： C21H32O
Molecular formula furigana： C21-H32-O
Molecular weight： 300.486
InChI：
InChI=1S/C21H32O/c1-15-7-6-8-16(2)13-17-14-22-21(5)12-11-18(10-9-15)20(3,4)19(17)21/h8-9,14,18-19H,6-7,10-13H2,1-5H3/b15-9+,16-8+/t18-,19?,21-/m0/s1
InChI key：
GJPZYEMYXSPVBF-WREMPKHCSA-N
SMILES：
C/C/1=C\C[C@H]2CC[C@]3(C)OC=C(C/C(=C/CC1)/C)C3C2(C)C
Systematic name (3)：
- (1R,3E,7E,13S)-4,8,13,16,16-ペンタメチル-12-オキサトリシクロ[8.5.2.013,17]ヘプタデカン-3,7,10-トリエン
- (3E,7E,10R,13S)-3,7,13,17,17-ペンタメチル-14-オキサトリシクロ[8.5.2.013,16]ヘプタデカ-1(15),3,7-トリエン
- (3E,7E,10R,13S)-3,7,13,17,17-pentamethyl-14-oxatricyclo[8.5.2.013,16]heptadeca-1(15),3,7-triene
- (1R,3E,7E,13S)-4,8,13,16,16-Pentamethyl-12-oxatricyclo[8.5.2.013,17]heptadecane-3,7,10-triene
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