Chem
J-GLOBAL ID:200907073600201775
Nikkaji number:J1.125.847F
Funebrine
フネブリン
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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:
C18 H24 N2 O5
Molecular formula furigana:
C18-H24-N2-O5
Molecular weight:
348.399
InChI:
InChI=1S/C18H24N2O5/c1-9-11(3)24-17(22)15(9)19-7-13-5-6-14(8-21)20(13)16-10(2)12(4)25-18(16)23/h5-7,9-12,15-16,21H,8H2,1-4H3/b19-7+/t9-,10-,11-,12-,15+,16+/m1/s1
InChI key:
RYQKWJPWKLPCHJ-NNWVDDQKSA-N
SMILES:
C[C@H]1OC(=O)[C@@H](/N=C/c2ccc(CO)n2[C@H]2[C@H](C)[C@@H](C)OC2=O)[C@@H]1C
Systematic name (5):
3β-[[(E)-[1-(2-オキソ-4α,5β-ジメチル-テトラヒドロフラン-3β-イル)-5-(ヒドロキシメチル)-1H-ピロール-2-イル]メチレン]アミノ]-4α,5β-ジメチル-4,5-ジヒドロフラン-2(3H)-オン
(3S)-3β-[2-[(E)-[(3S)-2-オキソ-4α,5β-ジメチルテトラヒドロフラン-3β-イル]イミノメチル]-5-(ヒドロキシメチル)-1-ピロリル]-4α,5β-ジメチルテトラヒドロフラン-2-オン
(3S,4S,5R)-3-[2-[(E)-[(3S,4S,5R)-2-オキソ-4,5-ジメチルテトラヒドロフラン-3-イル]イミノメチル]-5-(ヒドロキシメチル)-1-ピロリル]-4,5-ジメチルテトラヒドロフラン-2-オン
(3S,4S,5R)-3-{2-[(E)-{[(3S,4S,5R)-4,5-ジメチル-2-オキソオキソラン-3-イル]イミノ}メチル]-5-(ヒドロキシメチル)-1H-ピロール-1-イル}-4,5-ジメチルオキソラン-2-オン
(3S,4S,5R)-3-{2-[(E)-{[(3S,4S,5R)-4,5-dimethyl-2-oxooxolan-3-yl]imino}methyl]-5-(hydroxymethyl)-1H-pyrrol-1-yl}-4,5-dimethyloxolan-2-one
Other name (7):
Funebrine
(3S,4S,5R)-3-[2-[(E)-[(3S,4S,5R)-2-Oxo-4,5-dimethyltetrahydrofuran-3-yl]iminomethyl]-5-(hydroxymethyl)-1-pyrrolyl]-4,5-dimethyltetrahydrofuran-2-one
フネブリン
(-)-フネブリン
(-)-Funebrine
3β-[[(E)-[1-(2-Oxo-4α,5β-dimethyl-tetrahydrofuran-3β-yl)-5-(hydroxymethyl)-1H-pyrrole-2-yl]methylene]amino]-4α,5β-dimethyl-4,5-dihydrofuran-2(3H)-one
(3S)-3β-[2-[(E)-[(3S)-2-Oxo-4α,5β-dimethyltetrahydrofuran-3β-yl]iminomethyl]-5-(hydroxymethyl)-1-pyrrolyl]-4α,5β-dimethyltetrahydrofuran-2-one
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CAS registry number:
90605-98-4
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