Chem
J-GLOBAL ID:200907001829433113
Nikkaji number:J1.881.055G
(5S)-5,9-Diphenyl-7-oxo-5α,9α-epoxy-6,7,8,9-tetrahydro-5H-benzocycloheptene-6-acetaldehyde
(5S)-5,9-ジフェニル-7-オキソ-5α,9α-エポキシ-6,7,8,9-テトラヒドロ-5H-ベンゾシクロヘプテン-6-アセトアルデヒド
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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:
C25 H20 O3
Molecular formula furigana:
C25-H20-O3
Molecular weight:
368.432
InChI:
InChI=1S/C25H20O3/c26-16-15-22-23(27)17-24(18-9-3-1-4-10-18)20-13-7-8-14-21(20)25(22,28-24)19-11-5-2-6-12-19/h1-14,16,22H,15,17H2/t22?,24-,25+/m1/s1
InChI key:
UKKKVHOUKVYWIH-GOGAEGRDSA-N
SMILES:
O=CCC1C(=O)C[C@@]2(O[C@]1(c1ccccc21)c1ccccc1)c1ccccc1
Systematic name (3):
(5S)-5,9-ジフェニル-7-オキソ-5α,9α-エポキシ-6,7,8,9-テトラヒドロ-5H-ベンゾシクロヘプテン-6-アセトアルデヒド
2-[(1R,8S)-10-オキソ-1,8-ジフェニル-12-オキサトリシクロ[6.3.1.02,7 ]ドデカ-2,4,6-トリエン-9-イル]アセトアルデヒド
2-[(1R,8S)-10-oxo-1,8-diphenyl-12-oxatricyclo[6.3.1.02,7 ]dodeca-2,4,6-trien-9-yl]acetaldehyde
Other name (1):
(5S)-5,9-Diphenyl-7-oxo-5α,9α-epoxy-6,7,8,9-tetrahydro-5H-benzocycloheptene-6-acetaldehyde
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