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Corynan-18-carboxylic acid, 17-methoxy-17-oxo-, methyl ester, (15.alpha.)-(.+-.)-
SpectraBase Compound ID G2ItNgegKfO
InChI InChI=1S/C22H28N2O4/c1-27-20(25)8-7-14-13-24-10-9-17-16-5-3-4-6-18(16)23-22(17)19(24)11-15(14)12-21(26)28-2/h3-6,14-15,19,23H,7-13H2,1-2H3/t14?,15-,19?/m0/s1
InChIKey XWRKJBMYTVHJDX-HVEKOLDVSA-N
Mol Weight 384.48 g/mol
Molecular Formula C22H28N2O4
Exact Mass 384.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSKfiUmE6HZ
Name Corynan-18-carboxylic acid, 17-methoxy-17-oxo-, methyl ester, (15.alpha.)-(.+-.)-
CAS Registry Number 59952-48-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O4
InChI InChI=1S/C22H28N2O4/c1-27-20(25)8-7-14-13-24-10-9-17-16-5-3-4-6-18(16)23-22(17)19(24)11-15(14)12-21(26)28-2/h3-6,14-15,19,23H,7-13H2,1-2H3/t14?,15-,19?/m0/s1
InChIKey XWRKJBMYTVHJDX-HVEKOLDVSA-N
Molecular Weight 384.476 g/mol
SMILES [nH]1c2ccccc2c2c1C1N(CC2)CC([C@@](C1)(CC(=O)OC)[H])CCC(=O)OC
SPLASH splash10-001i-0109000000-7d6ea6476fc20afef734
Source of Spectrum K-109-1746-0
Synonyms Indolo[2,3-a]quinolizine, corynan-18-carboxylic acid deriv. Methyl 3-[(4S)-4-(2-methoxy-2-oxoethyl)-7,17-diazatetracyclo[8.7.0.0(2,7).0(11,16)]heptadeca-1(10),11,13,15-tetraen-5-yl]propanoate Methyl ester of 3-(2.beta.-(methoxycarbonylmethyl)-1,2,3,4,6,7,12,12b.beta.-octahydroindolo[2,3-a]quinolin-3.beta.-yl)propionic acid
Wiley ID 1361666