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(3beta-ethyl-8-hydroxy-9,10-dimethoxy-1,3,4,6,7,11balpha-hexahydro-2H-benzo[a]quinolizin-2beta-yl)acetic acid-methylester

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(3beta-ethyl-8-hydroxy-9,10-dimethoxy-1,3,4,6,7,11balpha-hexahydro-2H-benzo[a]quinolizin-2beta-yl)acetic acid-methylester
SpectraBase Compound ID 3v1S6kgDyvr
InChI InChI=1S/C20H29NO5/c1-5-12-11-21-7-6-14-15(10-17(24-2)20(26-4)19(14)23)16(21)8-13(12)9-18(22)25-3/h10,12-13,16,23H,5-9,11H2,1-4H3/t12-,13-,16+/m1/s1
InChIKey FMBIFCMIBQQVAR-IOASZLSFSA-N
Mol Weight 363.45 g/mol
Molecular Formula C20H29NO5
Exact Mass 363.204573 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7AnU2NntL1k
Name (3Beta-ethyl-8-hydroxy-9,10-dimethoxy-1,3,4,6,7,11BALPHA-hexahydro-2H-benzo[A]quinolizin-2beta-yl)acetic acid-methylester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.204573033 u
Formula C20H29NO5
InChI InChI=1S/C20H29NO5/c1-5-12-11-21-7-6-14-15(10-17(24-2)20(26-4)19(14)23)16(21)8-13(12)9-18(22)25-3/h10,12-13,16,23H,5-9,11H2,1-4H3/t12-,13-,16+/m1/s1
InChIKey FMBIFCMIBQQVAR-IOASZLSFSA-N
Molecular Weight 363.454 g/mol
SMILES [C@@]12(N(CCC=3C(=C(C(=CC23)OC)OC)O)C[C@]([C@](C1)(CC(OC)=O)[H])(CC)[H])[H]