Chem
J-GLOBAL ID:200907036639659156
Nikkaji number:J1.945.858J
Monascopyridine B
モナスコピリジンB
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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:
C23 H29 NO4
Molecular formula furigana:
C23-H29-N-O4
Molecular weight:
383.488
InChI:
InChI=1S/C23H29NO4/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/h5,10,12,14,18,20H,4,6-9,11,13H2,1-3H3/t18-,20+,23-/m0/s1
InChI key:
OYPJBWUSPIIITL-NOXFTYBFSA-N
SMILES:
CCCCCCCC(=O)[C@H]1[C@@H]2Cc3cc(C=CC)ncc3C(=O)[C@@]2(C)OC1=O
Systematic name (3):
(3R)-3β-オクタノイル-3aβ,9a-ジヒドロ-9aα-メチル-6-(1-プロペニル)フロ[3,2-g]イソキノリン-2,9(3H,4H)-ジオン
(3R,3aS,9aS)-9a-メチル-3-オクタノイル-6-(プロパ-1-エン-1-イル)-2H,3H,3aH,4H,9H,9aH-フロ[3,2-g]イソキノリン-2,9-ジオン
(3R,3aS,9aS)-9a-methyl-3-octanoyl-6-(prop-1-en-1-yl)-2H,3H,3aH,4H,9H,9aH-furo[3,2-g]isoquinoline-2,9-dione
Other name (3):
(3R)-3β-Octanoyl-3aβ,9a-dihydro-9aα-methyl-6-(1-propenyl)furo[3,2-g]isoquinoline-2,9(3H,4H)-dione
モナスコピリジンB
Monascopyridine B
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