Chem
J-GLOBAL ID：200907029334410747   Nikkaji number：J2.196.427A

(S,S)-Hexestrol

(S,S)-ヘキセストロール
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： C18H22O2
Molecular formula furigana： C18-H22-O2
Molecular weight： 270.372
InChI： InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3/t17-,18-/m1/s1
InChI key： PBBGSZCBWVPOOL-QZTJIDSGSA-N
SMILES： CC[C@@H]([C@H](CC)c1ccc(O)cc1)c1ccc(O)cc1
Systematic name  (3)：
  • (3S,4S)-3,4-ビス(p-ヒドロキシフェニル)ヘキサン
  • 4-[(3S,4S)-4-(4-ヒドロキシフェニル)ヘキサン-3-イル]フェノール
  • 4-[(3S,4S)-4-(4-hydroxyphenyl)hexan-3-yl]phenol
Other name (3)：
  • (3S,4S)-3,4-Bis(p-hydroxyphenyl)hexane
  • (S,S)-ヘキセストロール
  • (S,S)-Hexestrol
CAS registry number： 29555-62-2
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