Chem
J-GLOBAL ID:200907002348384638
Nikkaji number:J962.022B
(3R)-3β-[[(1R)-2α-Isopropyl-5β-methylcyclohexane-1β-yl]oxy]-3,3aβ,3bα,4,6aα,6bβ-hexahydro-1H-cyclopenta[3,4]cyclobuta[1,2-c]furan-1,6(5H)-dione
(1R,2R,5R,6R,7R)-5-{[(1R,2S,5R)-5-メチル-2-(プロパン-2-イル)シクロヘキシル]オキシ}-4-オキサトリシクロ[5.3.0.02,6 ]デカン-3,10-ジオン
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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:
C19 H28 O4
Molecular formula furigana:
C19-H28-O4
Molecular weight:
320.429
InChI:
InChI=1S/C19H28O4/c1-9(2)11-5-4-10(3)8-14(11)22-19-16-12-6-7-13(20)15(12)17(16)18(21)23-19/h9-12,14-17,19H,4-8H2,1-3H3/t10-,11+,12+,14-,15+,16-,17+,19-/m1/s1
InChI key:
FYPIBYXUQIPSFM-SMTPYFCCSA-N
SMILES:
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O[C@@H]1OC(=O)[C@@H]2[C@H]1[C@H]1CCC(=O)[C@@H]21
Systematic name (3):
(3R)-3β-[[(1R)-2α-イソプロピル-5β-メチルシクロヘキサン-1β-イル]オキシ]-3,3aβ,3bα,4,6aα,6bβ-ヘキサヒドロ-1H-シクロペンタ[3,4]シクロブタ[1,2-c]フラン-1,6(5H)-ジオン
(1R,2R,5R,6R,7R)-5-{[(1R,2S,5R)-5-メチル-2-(プロパン-2-イル)シクロヘキシル]オキシ}-4-オキサトリシクロ[5.3.0.02,6 ]デカン-3,10-ジオン
(1R,2R,5R,6R,7R)-5-{[(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-4-oxatricyclo[5.3.0.02,6 ]decane-3,10-dione
Other name (1):
(3R)-3β-[[(1R)-2α-Isopropyl-5β-methylcyclohexane-1β-yl]oxy]-3,3aβ,3bα,4,6aα,6bβ-hexahydro-1H-cyclopenta[3,4]cyclobuta[1,2-c]furan-1,6(5H)-dione
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