Chem
J-GLOBAL ID:200907083284030241   Nikkaji number:J529.301D

7-[2α-[4-(1-Hydroxyhexyl)phenyl]-5-oxocyclopentan-1β-yl]heptanoic acid

7-[2α-[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-1β-イル]ヘプタン酸
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: C24H36O4
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?/m0/s1
InChI key: XMQKDOCUWFCMEJ-LGTSYYJHSA-N
SMILES: CCCCCC(O)c1ccc(cc1)[C@@H]1CCC(=O)[C@H]1CCCCCCC(=O)O
Systematic name  (3):
  • 7-[2α-[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-1β-イル]ヘプタン酸
  • 7-[(1S,2R)-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-[(1S,2R)-2-[4-(1-hydroxyhexyl)phenyl]-5-oxocyclopentyl]heptanoic acid
Other name (1):
  • 7-[2α-[4-(1-Hydroxyhexyl)phenyl]-5-oxocyclopentan-1β-yl]heptanoic acid
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