Chem
J-GLOBAL ID：200907062761112762
Nikkaji number：J1.460.275E
(2S,6S,8S,12S)-7-Methyl-13-[(2-furyl)methoxy]-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradeca-13-ene-3,5,9,11-tetrone
(2S,6S,8S,12S)-7-メチル-13-[(2-フリル)メトキシ]-4,10-ジアザテトラシクロ[5.5.2.02,6.08,12]テトラデカ-13-エン-3,5,9,11-テトラオン
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
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
Molecular formula： C18H16N2O6
Molecular formula furigana： C18-H16-N2-O6
Molecular weight： 356.334
InChI：
InChI=1S/C18H16N2O6/c1-18-5-8(26-6-7-3-2-4-25-7)9(10-12(18)16(23)19-14(10)21)11-13(18)17(24)20-15(11)22/h2-5,9-13H,6H2,1H3,(H,19,21,23)(H,20,22,24)/t9?,10-,11-,12+,13+,18?/m0/s1
InChI key：
VPHSCIMPTRQGLN-YGOCIAKOSA-N
SMILES：
CC12C=C(OCc3ccco3)C([C@H]3[C@@H]1C(=O)NC3=O)[C@H]1[C@@H]2C(=O)NC1=O
Systematic name (3)：
- (2S,6S,8S,12S)-7-メチル-13-[(2-フリル)メトキシ]-4,10-ジアザテトラシクロ[5.5.2.02,6.08,12]テトラデカ-13-エン-3,5,9,11-テトラオン
- (2S,6S,8S,12S)-14-[(フラン-2-イル)メトキシ]-1-メチル-4,10-ジアザテトラシクロ[5.5.2.02,6.08,12]テトラデカ-13-エン-3,5,9,11-テトラオン
- (2S,6S,8S,12S)-14-[(furan-2-yl)methoxy]-1-methyl-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone
- (2S,6S,8S,12S)-7-Methyl-13-[(2-furyl)methoxy]-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradeca-13-ene-3,5,9,11-tetrone
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