Chem
J-GLOBAL ID：200907041612194104   Nikkaji number：J583.640I

Monascorubramine

モナスコルブラミン
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： C23H27NO4
Molecular formula furigana： C23-H27-N-O4
Molecular weight： 381.472
InChI： InChI=1S/C23H27NO4/c1-4-6-7-8-9-11-19(25)20-18-13-15-12-16(10-5-2)24-14-17(15)21(26)23(18,3)28-22(20)27/h5,10,12-14,24H,4,6-9,11H2,1-3H3/b10-5+/t23-/m1/s1
InChI key： QCUYNKMUDZHGNK-HAOIVFDCSA-N
SMILES： CCCCCCCC(=O)C1=C2C=c3cc([nH]cc3C(=O)[C@]2(C)OC1=O)/C=C/C
Systematic name  (3)：
  • (9aR)-3-(1-オキソオクチル)-6-[(E)-1-プロペニル]-9a-メチルフロ[3,2-g]イソキノリン-2,9(7H,9aH)-ジオン
  • (9aR)-9a-メチル-3-オクタノイル-6-[(1E)-プロパ-1-エン-1-イル]-2H,7H,9H,9aH-フロ[3,2-g]イソキノリン-2,9-ジオン
  • (9aR)-9a-methyl-3-octanoyl-6-[(1E)-prop-1-en-1-yl]-2H,7H,9H,9aH-furo[3,2-g]isoquinoline-2,9-dione
Other name (3)：
  • モナスコルブラミン
  • Monascorubramine
  • (9aR)-3-(1-Oxooctyl)-6-[(E)-1-propenyl]-9a-methylfuro[3,2-g]isoquinoline-2,9(7H,9aH)-dione
CAS registry number： 3627-51-8
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