Chem
J-GLOBAL ID:200907018666862321
Nikkaji number:J2.678.071C
(1S,4S,5R,6S)-1-Methyl-4-isopropyl-2,3-dioxabicyclo[2.2.2]octane-5,6-diol
(1S,4S,5R,6S)-1-メチル-4-イソプロピル-2,3-ジオキサビシクロ[2.2.2]オクタン-5,6-ジオール
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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:
C10 H18 O4
Molecular formula furigana:
C10-H18-O4
Molecular weight:
202.250
InChI:
InChI=1S/C10H18O4/c1-6(2)10-5-4-9(3,13-14-10)7(11)8(10)12/h6-8,11-12H,4-5H2,1-3H3/t7-,8+,9-,10-/m0/s1
InChI key:
VKRVOHWSLZHMHA-JXUBOQSCSA-N
SMILES:
CC(C)[C@]12CC[C@](C)(OO1)[C@@H](O)[C@H]2O
Systematic name (3):
(1S,4S,5R,6S)-1-メチル-4-イソプロピル-2,3-ジオキサビシクロ[2.2.2]オクタン-5,6-ジオール
(1S,4S,5R,6S)-1-メチル-4-(プロパン-2-イル)-2,3-ジオキサビシクロ[2.2.2]オクタン-5,6-ジオール
(1S,4S,5R,6S)-1-methyl-4-(propan-2-yl)-2,3-dioxabicyclo[2.2.2]octane-5,6-diol
Other name (1):
(1S,4S,5R,6S)-1-Methyl-4-isopropyl-2,3-dioxabicyclo[2.2.2]octane-5,6-diol
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