Chem
J-GLOBAL ID:200907047541623511
Nikkaji number:J1.538.042J
(2R)-2β-[(R)-1-Hydroxyethyl]-4,4,7aα-trimethyl-2,4,5,6,7,7a-hexahydrobenzofuran-6α-ol
(2R)-2β-[(R)-1-ヒドロキシエチル]-4,4,7aα-トリメチル-2,4,5,6,7,7a-ヘキサヒドロベンゾフラン-6α-オール
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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:
C13 H22 O3
Molecular formula furigana:
C13-H22-O3
Molecular weight:
226.316
InChI:
InChI=1S/C13H22O3/c1-8(14)10-5-11-12(2,3)6-9(15)7-13(11,4)16-10/h5,8-10,14-15H,6-7H2,1-4H3/t8-,9+,10-,13-/m1/s1
InChI key:
JZZFHGHGUGITAS-BSTOTGJRSA-N
SMILES:
C[C@@H](O)[C@@H]1O[C@]2(C)C[C@@H](O)CC(C)(C)C2=C1
Systematic name (3):
(2R)-2β-[(R)-1-ヒドロキシエチル]-4,4,7aα-トリメチル-2,4,5,6,7,7a-ヘキサヒドロベンゾフラン-6α-オール
(2R,6S,7aR)-2-[(1R)-1-ヒドロキシエチル]-4,4,7a-トリメチル-2,4,5,6,7,7a-ヘキサヒドロ-1-ベンゾフラン-6-オール
(2R,6S,7aR)-2-[(1R)-1-hydroxyethyl]-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-6-ol
Other name (1):
(2R)-2β-[(R)-1-Hydroxyethyl]-4,4,7aα-trimethyl-2,4,5,6,7,7a-hexahydrobenzofuran-6α-ol
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