Chem
J-GLOBAL ID:200907025135244662   Nikkaji number:J2.343.558F

(1R,3aα)-1β-[(R)-1,5-Dimethylhexyl]-7aβ-methylhydrindane-4β,5β-diol

(1R,3aα)-1β-[(R)-1,5-ジメチルヘキシル]-7aβ-メチルヒドリンダン-4β,5β-ジオール
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: C18H34O2
Molecular formula furigana: C18-H34-O2
Molecular weight: 282.468
InChI: InChI=1S/C18H34O2/c1-12(2)6-5-7-13(3)14-8-9-15-17(20)16(19)10-11-18(14,15)4/h12-17,19-20H,5-11H2,1-4H3/t13-,14-,15+,16+,17-,18-/m1/s1
InChI key: SHHGGLDZYIYLEU-GVLSGGHMSA-N
SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H](O)[C@@H](O)CC[C@]12C
Systematic name  (4):
  • (1R,3aα)-1β-[(R)-1,5-ジメチルヘキシル]-7aβ-メチルヒドリンダン-4β,5β-ジオール
  • (3aα)-1β-[(1R)-1,5-ジメチルヘキシル]-7aβ-メチルオクタヒドロ-1H-インデン-4β,5β-ジオール
  • (1R,3aR,4R,5S,7aR)-7a-メチル-1-[(2R)-6-メチルヘプタン-2-イル]-オクタヒドロ-1H-インデン-4,5-ジオール
  • (1R,3aR,4R,5S,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-octahydro-1H-indene-4,5-diol
Other name (2):
  • (1R,3aα)-1β-[(R)-1,5-Dimethylhexyl]-7aβ-methylhydrindane-4β,5β-diol
  • (3aα)-1β-[(1R)-1,5-Dimethylhexyl]-7aβ-methyloctahydro-1H-indene-4β,5β-diol
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