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3-[2-(1-Isopropyloxycarbonyl-4-ethyl-7-hydroxyheptyl)carbonylamidoethyl]indole
SpectraBase Compound ID Cwtwi63HkN1
InChI InChI=1S/C23H34N2O4/c1-4-23(12-7-15-26,13-10-21(27)29-17(2)3)22(28)24-14-11-18-16-25-20-9-6-5-8-19(18)20/h5-6,8-9,16-17,25-26H,4,7,10-15H2,1-3H3,(H,24,28)/t23-/m0/s1
InChIKey NZXYIZPRKZBIFF-QHCPKHFHSA-N
Mol Weight 402.5 g/mol
Molecular Formula C23H34N2O4
Exact Mass 402.251858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBR9dUkGTAb
Name 3-[2-(1-Isopropyloxycarbonyl-4-ethyl-7-hydroxyheptyl)carbonylamidoethyl]indole
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Formula C23H34N2O4
InChI InChI=1S/C23H34N2O4/c1-4-23(12-7-15-26,13-10-21(27)29-17(2)3)22(28)24-14-11-18-16-25-20-9-6-5-8-19(18)20/h5-6,8-9,16-17,25-26H,4,7,10-15H2,1-3H3,(H,24,28)/t23-/m0/s1
InChIKey NZXYIZPRKZBIFF-QHCPKHFHSA-N
Molecular Weight 402.535 g/mol
SMILES [nH]1c2c(c(CCNC([C@@](CCCO)(CCC(=O)OC(C)C)CC)=O)c1)cccc2
SPLASH splash10-0006-0910000000-605775c0244955de95b5
Source of Spectrum QC-8-1966-9
Synonyms (R)-3-[2-(1-Isopropyloxycarbonyl-4-ethyl-7-hydroxyheptyl)carbonylamidoethyl]indole (4S)-4-ethyl-7-hydroxy-4-[[2-(1H-indol-3-yl)ethylamino]-oxomethyl]heptanoic acid propan-2-yl ester Propan-2-yl (4S)-4-ethyl-7-hydroxy-4-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate isopropyl (4S)-4-ethyl-7-hydroxy-4-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate Propan-2-yl (4S)-4-ethyl-4-[2-(1H-indol-3-yl)ethylcarbamoyl]-7-oxidanyl-heptanoate
Wiley ID 870098