Chem
J-GLOBAL ID:200907068064873010
Nikkaji number:J1.715.994A
2-Acetoxybeyera-1,15-diene-3,12-dione
2-アセトキシベイエラ-1,15-ジエン-3,12-ジオン
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Substance type:
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
Molecular formula:
C22 H28 O4
Molecular formula furigana:
C22-H28-O4
Molecular weight:
356.462
InChI:
InChI=1S/C22H28O4/c1-13(23)26-14-11-21(5)15(19(2,3)18(14)25)6-7-22-9-8-20(4,12-22)17(24)10-16(21)22/h8-9,11,15-16H,6-7,10,12H2,1-5H3/t15-,16+,20-,21-,22+/m0/s1
InChI key:
RTPXQSGEIGDEKG-UDBCTEGJSA-N
SMILES:
CC(=O)OC1=C[C@]2(C)[C@H]3CC(=O)[C@]4(C)C[C@@]3(CC[C@H]2C(C)(C)C1=O)C=C4
Systematic name (3):
2-アセトキシベイエラ-1,15-ジエン-3,12-ジオン
(1S,4R,9R,10S,13R)-5,5,9,13-テトラメチル-6,12-ジオキソテトラシクロ[11.2.1.01,10 .04,9 ]ヘキサデカ-7,14-ジエン-7-イル アセタート
(1S,4R,9R,10S,13R)-5,5,9,13-tetramethyl-6,12-dioxotetracyclo[11.2.1.01,10 .04,9 ]hexadeca-7,14-dien-7-yl acetate
Other name (1):
2-Acetoxybeyera-1,15-diene-3,12-dione
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