Chem
J-GLOBAL ID:200907038866267399
Nikkaji number:J529.300F
7-[2β-[4-(1-Hydroxyhexyl)phenyl]-5-oxocyclopentan-1α-yl]heptanoic acid
7-[2β-[4-(1-ヒドロキシヘキシル)フェニル]-5-オキソシクロペンタン-1α-イル]ヘプタン酸
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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:
C24 H36 O4
Molecular formula furigana:
C24-H36-O4
Molecular weight:
388.548
InChI:
InChI=1S/C24H36O4/c1-2-3-6-10-22(25)19-14-12-18(13-15-19)20-16-17-23(26)21(20)9-7-4-5-8-11-24(27)28/h12-15,20-22,25H,2-11,16-17H2,1H3,(H,27,28)/t20-,21-,22?/m1/s1
InChI key:
XMQKDOCUWFCMEJ-JAZPPYFYSA-N
SMILES:
CCCCCC(O)c1ccc(cc1)[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)O
Systematic name (3):
7-[2β-[4-(1-ヒドロキシヘキシル)フェニル]-5-オキソシクロペンタン-1α-イル]ヘプタン酸
7-[(1R,2S)-2-[4-(1-ヒドロキシヘキシル)フェニル]-5-オキソシクロペンチル]ヘプタン酸
7-[(1R,2S)-2-[4-(1-hydroxyhexyl)phenyl]-5-oxocyclopentyl]heptanoic acid
Other name (1):
7-[2β-[4-(1-Hydroxyhexyl)phenyl]-5-oxocyclopentan-1α-yl]heptanoic acid
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