Chem
J-GLOBAL ID：200907066761582900   Nikkaji number：J590.528A

Harzianic acid

ハルジアン酸
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： C19H27NO6
Molecular formula furigana： C19-H27-N-O6
Molecular weight： 365.426
InChI： InChI=1S/C19H27NO6/c1-5-6-7-8-9-10-14(21)15-16(22)13(20(4)17(15)23)11-19(26,12(2)3)18(24)25/h7-10,12-13,21,26H,5-6,11H2,1-4H3,(H,24,25)/b8-7+,10-9+,15-14-/t13-,19-/m0/s1
InChI key： FQSWTHMMNDRFAI-GOVSHCJESA-N
SMILES： CCC/C=C/C=C/C(=C/1\C(=O)[C@H](C[C@](O)(C(C)C)C(=O)O)N(C)C1=O)/O
Systematic name  (3)：
  • (αS,2S,4Z)-4-[(2E,4E)-1-ヒドロキシオクタ-2,4-ジエニリデン]-α-ヒドロキシ-α-イソプロピル-1-メチル-3,5-ジオキソピロリジン-2-プロピオン酸
  • (2S)-2-ヒドロキシ-2-{[(2S,4Z)-4-[(2E,4E)-1-ヒドロキシオクタ-2,4-ジエン-1-イリデン]-1-メチル-3,5-ジオキソピロリジン-2-イル]メチル}-3-メチルブタン酸
  • (2S)-2-hydroxy-2-{[(2S,4Z)-4-[(2E,4E)-1-hydroxyocta-2,4-dien-1-ylidene]-1-methyl-3,5-dioxopyrrolidin-2-yl]methyl}-3-methylbutanoic acid
Other name (3)：
  • ハルジアン酸
  • Harzianic acid
  • (αS,2S,4Z)-4-[(2E,4E)-1-Hydroxyocta-2,4-dienylidene]-α-hydroxy-α-isopropyl-1-methyl-3,5-dioxopyrrolidine-2-propionic acid
CAS registry number： 157148-06-6
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