Chem
J-GLOBAL ID：200907047543260823   Nikkaji number：J1.000.719D

(2R)-1,19-Dioxo-2,7,13,17-tetramethyl-3-[(E)-ethylidene]-5-(allyloxycarbonyl)-18-ethyl-1,2,3,19,22,24-hexahydro-21H-biline-8,12-dipropanoic acid diallyl ester

(2R)-1,19-ジオキソ-2,7,13,17-テトラメチル-3-[(E)-エチリデン]-5-(アリルオキシカルボニル)-18-エチル-1,2,3,19,22,24-ヘキサヒドロ-21H-ビリン-8,12-ジプロパン酸ジアリル
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： C43H50N4O8
Molecular formula furigana： C43-H50-N4-O8
Molecular weight： 750.893
InChI： InChI=1S/C43H50N4O8/c1-10-19-53-36(48)17-15-30-25(7)32(22-33-24(6)29(14-5)42(51)46-33)44-34(30)23-35-31(16-18-37(49)54-20-11-2)26(8)39(45-35)38(43(52)55-21-12-3)40-28(13-4)27(9)41(50)47-40/h10-13,22-23,27,45H,1-3,14-21H2,4-9H3,(H,46,51)(H,47,50)/b28-13+,33-22?,34-23?,40-38?/t27-/m1/s1
InChI key： PUKOFXPQFNLZIS-JHIZUBCBSA-N
SMILES： CCC1=C(C)C(=CC2=NC(=Cc3[nH]c(C(=C4NC(=O)[C@H](C)/C/4=C\C)C(=O)OCC=C)c(C)c3CCC(=O)OCC=C)C(=C2C)CCC(=O)OCC=C)NC1=O
Systematic name  (3)：
  • (2R)-1,19-ジオキソ-2,7,13,17-テトラメチル-3-[(E)-エチリデン]-5-(アリルオキシカルボニル)-18-エチル-1,2,3,19,22,24-ヘキサヒドロ-21H-ビリン-8,12-ジプロパン酸ジアリル
  • プロパ-2-エン-1-イル 3-{5-[(4-エチル-3-メチル-5-オキソ-2,5-ジヒドロ-1H-ピロール-2-イリデン)メチル]-2-[(5-{1-[(3E,4R)-3-エチリデン-4-メチル-5-オキソピロリジン-2-イリデン]-2-オキソ-2-(プロパ-2-エン-1-イルオキシ)エチル}-4-メチル-3-[3-オキソ-3-(プロパ-2-エン-1-イルオキシ)プロピル]-1H-ピロール-2-イル)メチリデン]-4-メチル-2H-ピロール-3-イル}プロパノアート
  • prop-2-en-1-yl 3-{5-[(4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene)methyl]-2-[(5-{1-[(3E,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]-2-oxo-2-(prop-2-en-1-yloxy)ethyl}-4-methyl-3-[3-oxo-3-(prop-2-en-1-yloxy)propyl]-1H-pyrrol-2-yl)methylidene]-4-methyl-2H-pyrrol-3-yl}propanoate
Other name (1)：
  • (2R)-1,19-Dioxo-2,7,13,17-tetramethyl-3-[(E)-ethylidene]-5-(allyloxycarbonyl)-18-ethyl-1,2,3,19,22,24-hexahydro-21H-biline-8,12-dipropanoic acid diallyl ester
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