Chem
J-GLOBAL ID:201407081586945564
Nikkaji number:J3.258.388A
Malonic acid 1-methyl 3-[(1Z,5E,8E)-4,4,8-trimethyl-7-oxo-1,5,8-cycloundecatriene-1-yl]methyl ester
マロン酸1-メチル3-[(1Z,5E,8E)-4,4,8-トリメチル-7-オキソ-1,5,8-シクロウンデカトリエン-1-イル]メチル
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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:
C19 H26 O5
Molecular formula furigana:
C19-H26-O5
Molecular weight:
334.412
InChI:
InChI=1S/C19H26O5/c1-14-6-5-7-15(13-24-18(22)12-17(21)23-4)8-10-19(2,3)11-9-16(14)20/h6,8-9,11H,5,7,10,12-13H2,1-4H3/b11-9+,14-6+,15-8-
InChI key:
PUKFIMMBKXGWLX-GQLPGEDNSA-N
SMILES:
COC(=O)CC(=O)OC/C/1=C\CC(C)(C)/C=C/C(=O)/C(=C/CC1)/C
Systematic name (3):
マロン酸1-メチル3-[(1Z,5E,8E)-4,4,8-トリメチル-7-オキソ-1,5,8-シクロウンデカトリエン-1-イル]メチル
1-メチル 3-[(1Z,5E,8E)-4,4,8-トリメチル-7-オキソシクロウンデカ-1,5,8-トリエン-1-イル]メチル プロパンジオアート
1-methyl 3-[(1Z,5E,8E)-4,4,8-trimethyl-7-oxocycloundeca-1,5,8-trien-1-yl]methyl propanedioate
Other name (1):
Malonic acid 1-methyl 3-[(1Z,5E,8E)-4,4,8-trimethyl-7-oxo-1,5,8-cycloundecatriene-1-yl]methyl ester
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