Chem
J-GLOBAL ID:200907072238895945
Nikkaji number:J2.215.682I
Callicarpenal
カリカルペナル
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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:
C16 H26 O
Molecular formula furigana:
C16-H26-O
Molecular weight:
234.383
InChI:
InChI=1S/C16H26O/c1-12-6-5-7-14-15(12,3)9-8-13(2)16(14,4)10-11-17/h6,11,13-14H,5,7-10H2,1-4H3/t13-,14+,15+,16+/m1/s1
InChI key:
MPWIIQYWQOBNKS-UGUYLWEFSA-N
SMILES:
C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C)[C@@]1(C)CC=O
Systematic name (3):
(1S)-1,2α,4aα,5-テトラメチル-1,2,3,4,4a,7,8,8aβ-オクタヒドロナフタレン-1β-アセトアルデヒド
2-[(1S,2R,4aR,8aR)-1,2,4a,5-テトラメチル-1,2,3,4,4a,7,8,8a-オクタヒドロナフタレン-1-イル]アセトアルデヒド
2-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]acetaldehyde
Other name (6):
(1S)-1,2α,4aα,5-Tetramethyl-1,2,3,4,4a,7,8,8aβ-octahydronaphthalene-1β-acetaldehyde
カリカルペナル
カリカルペナール
Callicarpenal
(-)-カリカルペナール
(-)-Callicarpenal
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CAS registry number:
161105-12-0
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