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N-(5-(Methoxycarbonyl)-2-oxopentyl)monamide
SpectraBase Compound ID BWJYxfW0xcp
InChI InChI=1S/C24H39NO9/c1-13(9-20(28)25-11-17(27)6-5-7-21(29)32-4)8-18-23(31)22(30)16(12-33-18)10-19-24(34-19)14(2)15(3)26/h9,14-16,18-19,22-24,26,30-31H,5-8,10-12H2,1-4H3,(H,25,28)/b13-9+/t14-,15-,16-,18-,19-,22+,23-,24-/m0/s1
InChIKey IEFSFRLLRUMFPF-BBWHYXRKSA-N
Mol Weight 485.6 g/mol
Molecular Formula C24H39NO9
Exact Mass 485.262482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SNTyYBR4Wp
Name N-(5-(Methoxycarbonyl)-2-oxopentyl)monamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H39NO9
InChI InChI=1S/C24H39NO9/c1-13(9-20(28)25-11-17(27)6-5-7-21(29)32-4)8-18-23(31)22(30)16(12-33-18)10-19-24(34-19)14(2)15(3)26/h9,14-16,18-19,22-24,26,30-31H,5-8,10-12H2,1-4H3,(H,25,28)/b13-9+/t14-,15-,16-,18-,19-,22+,23-,24-/m0/s1
InChIKey IEFSFRLLRUMFPF-BBWHYXRKSA-N
Molecular Weight 485.574 g/mol
SMILES O[C@]([C@@]([C@@]1(O[C@]1(C[C@]1(CO[C@]([C@@]([C@@]1(O)[H])(O)[H])(C\C(=C\C(NCC(=O)CCCC(=O)OC)=O)C)[H])[H])[H])[H])(C)[H])(C)[H]
SPLASH splash10-0006-0093300000-4eeaabe2b74b07672258
Source of Spectrum E1-39-450-3
Synonyms 6-[[(E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]-2-oxiranyl]methyl]-2-oxanyl]-3-methyl-1-oxobut-2-enyl]amino]-5-oxohexanoic acid methyl ester Methyl 6-[[(E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methylbut-2-enoyl]amino]-5-oxohexanoate Methyl 6-[[(E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]methyl]tetrahydropyran-2-yl]-3-methyl-but-2-enoyl]amino]-5-oxo-hexanoate Methyl 6-[[(E)-4-[(2S,3R,4R,5S)-3,4-bis(oxidanyl)-5-[[(2S,3S)-3-[(2S,3S)-3-oxidanylbutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methyl-but-2-enoyl]amino]-5-oxidanylidene-hexanoate
Wiley ID 1598693