Chem
J-GLOBAL ID:200907054937883695
Nikkaji number:J720.188E
4β-Hydroxy-6α-(benzyloxy)-1-cyclohexene-1-carboxylic acid methyl ester
4β-ヒドロキシ-6α-(ベンジルオキシ)-1-シクロヘキセン-1-カルボン酸メチル
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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:
C15 H18 O4
Molecular formula furigana:
C15-H18-O4
Molecular weight:
262.305
InChI:
InChI=1S/C15H18O4/c1-18-15(17)13-8-7-12(16)9-14(13)19-10-11-5-3-2-4-6-11/h2-6,8,12,14,16H,7,9-10H2,1H3/t12-,14+/m1/s1
InChI key:
SSYCOTBEQBEHIV-OCCSQVGLSA-N
SMILES:
COC(=O)C1=CC[C@@H](O)C[C@@H]1OCc1ccccc1
Systematic name (3):
4β-ヒドロキシ-6α-(ベンジルオキシ)-1-シクロヘキセン-1-カルボン酸メチル
メチル (4R,6S)-6-(ベンジルオキシ)-4-ヒドロキシシクロヘキサ-1-エン-1-カルボキシラート
methyl (4R,6S)-6-(benzyloxy)-4-hydroxycyclohex-1-ene-1-carboxylate
Other name (1):
4β-Hydroxy-6α-(benzyloxy)-1-cyclohexene-1-carboxylic acid methyl ester
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