Chem
J-GLOBAL ID:200907016048174950   Nikkaji number:J1.195.501K

(3S,5R)-3,5-Dihydroxy-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-6-heptenoic acid

(3S,5R)-3,5-ジヒドロキシ-7-[2-シクロプロピル-4-(4-フルオロフェニル)-3-キノリニル]-6-ヘプテン酸
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: C25H24FNO4
Molecular formula furigana: C25-H24-F-N-O4
Molecular weight: 421.468
InChI: InChI=1S/C25H24FNO4/c26-17-9-7-15(8-10-17)24-20-3-1-2-4-22(20)27-25(16-5-6-16)21(24)12-11-18(28)13-19(29)14-23(30)31/h1-4,7-12,16,18-19,28-29H,5-6,13-14H2,(H,30,31)/t18-,19-/m0/s1
InChI key: VGYFMXBACGZSIL-OALUTQOASA-N
SMILES: O[C@@H](C[C@@H](O)C=Cc1c(nc2ccccc2c1c1ccc(F)cc1)C1CC1)CC(=O)O
Systematic name  (3):
  • (3S,5R)-3,5-ジヒドロキシ-7-[2-シクロプロピル-4-(4-フルオロフェニル)-3-キノリニル]-6-ヘプテン酸
  • (3S,5R)-7-[2-シクロプロピル-4-(4-フルオロフェニル)キノリン-3-イル]-3,5-ジヒドロキシヘプタ-6-エン酸
  • (3S,5R)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoic acid
Other name (1):
  • (3S,5R)-3,5-Dihydroxy-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-6-heptenoic acid
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