Chem
J-GLOBAL ID:200907048239220072   Nikkaji number:J2.509.771H

(2S,3S)-N-(Cyclohexylhydroxymethyl)-2-(benzoyloxy)-3-methoxy-5-methyl-5-hexeneamide

(2S,3S)-N-(シクロヘキシルヒドロキシメチル)-2-(ベンゾイルオキシ)-3-メトキシ-5-メチル-5-ヘキセンアミド
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: C22H31NO5
Molecular formula furigana: C22-H31-N-O5
Molecular weight: 389.492
InChI: InChI=1S/C22H31NO5/c1-15(2)14-18(27-3)19(28-22(26)17-12-8-5-9-13-17)21(25)23-20(24)16-10-6-4-7-11-16/h5,8-9,12-13,16,18-20,24H,1,4,6-7,10-11,14H2,2-3H3,(H,23,25)/t18-,19-,20?/m0/s1
InChI key: QVESALPCUCGBCS-NFBCFJMWSA-N
SMILES: CO[C@@H](CC(=C)C)[C@H](OC(=O)c1ccccc1)C(=O)NC(O)C1CCCCC1
Systematic name  (3):
  • (2S,3S)-N-(シクロヘキシルヒドロキシメチル)-2-(ベンゾイルオキシ)-3-メトキシ-5-メチル-5-ヘキセンアミド
  • (1S,2S)-1-{[シクロヘキシル(ヒドロキシ)メチル]カルバモイル}-2-メトキシ-4-メチルペンタ-4-エン-1-イル ベンゾアート
  • (1S,2S)-1-{[cyclohexyl(hydroxy)methyl]carbamoyl}-2-methoxy-4-methylpent-4-en-1-yl benzoate
Other name (1):
  • (2S,3S)-N-(Cyclohexylhydroxymethyl)-2-(benzoyloxy)-3-methoxy-5-methyl-5-hexeneamide
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