Chem
J-GLOBAL ID：200907030070403265   Nikkaji number：J1.808.075C

N-[5-[(3aβ,6aβ)-2-Oxohexahydro-1H-thieno[3,4-d]imidazole-4α-yl]pentanoyl]glycine (3R,4Z,6E)-3-methyl-5-ethyl-7-[(2S)-3,6-dihydro-3β-methyl-6-oxo-2H-pyran-2β-yl]-4,6-heptadienyl ester

N-[5-[(3aβ,6aβ)-2-オキソヘキサヒドロ-1H-チエノ[3,4-d]イミダゾール-4α-イル]ペンタノイル]グリシン(3R,4Z,6E)-3-メチル-5-エチル-7-[(2S)-3,6-ジヒドロ-3β-メチル-6-オキソ-2H-ピラン-2β-イル]-4,6-ヘプタジエニル
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： C28H41N3O6S
Molecular formula furigana： C28-H41-N3-O6-S
Molecular weight： 547.710
InChI： InChI=1S/C28H41N3O6S/c1-4-20(10-11-22-19(3)9-12-25(33)37-22)15-18(2)13-14-36-26(34)16-29-24(32)8-6-5-7-23-27-21(17-38-23)30-28(35)31-27/h9-12,15,18-19,21-23,27H,4-8,13-14,16-17H2,1-3H3,(H,29,32)(H2,30,31,35)/b11-10+,20-15-/t18-,19+,21+,22+,23+,27+/m1/s1
InChI key： GOQVHTJYELJXDQ-OKCSDTSGSA-N
SMILES： CC/C(=C/[C@H](C)CCOC(=O)CNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)/C=C/[C@@H]1OC(=O)C=C[C@@H]1C
Systematic name  (3)：
  • N-[5-[(3aβ,6aβ)-2-オキソヘキサヒドロ-1H-チエノ[3,4-d]イミダゾール-4α-イル]ペンタノイル]グリシン(3R,4Z,6E)-3-メチル-5-エチル-7-[(2S)-3,6-ジヒドロ-3β-メチル-6-オキソ-2H-ピラン-2β-イル]-4,6-ヘプタジエニル
  • (3R,4Z,6E)-5-エチル-3-メチル-7-[(2S,3S)-3-メチル-6-オキソ-3,6-ジヒドロ-2H-ピラン-2-イル]ヘプタ-4,6-ジエン-1-イル 2-{5-[(3aS,4S,6aR)-2-オキソ-ヘキサヒドロ-1H-チエノ[3,4-d]イミダゾール-4-イル]ペンタンアミド}アセタート
  • (3R,4Z,6E)-5-ethyl-3-methyl-7-[(2S,3S)-3-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]hepta-4,6-dien-1-yl 2-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}acetate
Other name (1)：
  • N-[5-[(3aβ,6aβ)-2-Oxohexahydro-1H-thieno[3,4-d]imidazole-4α-yl]pentanoyl]glycine (3R,4Z,6E)-3-methyl-5-ethyl-7-[(2S)-3,6-dihydro-3β-methyl-6-oxo-2H-pyran-2β-yl]-4,6-heptadienyl ester
Thsaurus map：
Thesaurus Map

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