Chem
J-GLOBAL ID：200907072886815159   Nikkaji number：J1.431.705H

(3R,5R)-3,5-Dihydroxy-7-[(1S,2S,6R,8aR)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalene-1-yl]heptanoic acid

(3R,5R)-3,5-ジヒドロキシ-7-[(1S,2S,6R,8aR)-2,6-ジメチル-1,2,6,7,8,8a-ヘキサヒドロナフタレン-1-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： C19H30O4
Molecular formula furigana： C19-H30-O4
Molecular weight： 322.445
InChI： InChI=1S/C19H30O4/c1-12-3-7-18-14(9-12)5-4-13(2)17(18)8-6-15(20)10-16(21)11-19(22)23/h4-5,9,12-13,15-18,20-21H,3,6-8,10-11H2,1-2H3,(H,22,23)/t12-,13+,15-,16-,17+,18+/m1/s1
InChI key： RPDSFBJYUHLDNI-MHMDBQTNSA-N
SMILES： C[C@@H]1CC[C@@H]2[C@@H](CC[C@@H](O)C[C@@H](O)CC(=O)O)[C@@H](C)C=CC2=C1
Systematic name  (3)：
  • (3R,5R)-3,5-ジヒドロキシ-7-[(1S,2S,6R,8aR)-2,6-ジメチル-1,2,6,7,8,8a-ヘキサヒドロナフタレン-1-イル]ヘプタン酸
  • (3R,5R)-7-[(1S,2S,6R,8aR)-2,6-ジメチル-1,2,6,7,8,8a-ヘキサヒドロナフタレン-1-イル]-3,5-ジヒドロキシヘプタン酸
  • (3R,5R)-7-[(1S,2S,6R,8aR)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid
Other name (1)：
  • (3R,5R)-3,5-Dihydroxy-7-[(1S,2S,6R,8aR)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalene-1-yl]heptanoic acid
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