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(-)-(4bS,10bS,12S)-N-Benzyl-8,9-dimethoxy-12-methyl-2,3-methylenedioxy-4b,5,6,10b,11,12-hexahydrobenzo[c]phenanthridine
SpectraBase Compound ID dUzD3C2MSI
InChI InChI=1S/C28H29NO4/c1-17-9-22-21-12-25(31-3)24(30-2)10-19(21)15-29(14-18-7-5-4-6-8-18)28(22)23-13-27-26(11-20(17)23)32-16-33-27/h4-8,10-13,17,22,28H,9,14-16H2,1-3H3/t17-,22-,28-/m0/s1
InChIKey KDWXRJQJWMAHSW-BZWCRFLISA-N
Mol Weight 443.54 g/mol
Molecular Formula C28H29NO4
Exact Mass 443.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4M91VEUCJH
Name (-)-(4bS,10bS,12S)-N-Benzyl-8,9-dimethoxy-12-methyl-2,3-methylenedioxy-4b,5,6,10b,11,12-hexahydrobenzo[c]phenanthridine
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Formula C28H29NO4
InChI InChI=1S/C28H29NO4/c1-17-9-22-21-12-25(31-3)24(30-2)10-19(21)15-29(14-18-7-5-4-6-8-18)28(22)23-13-27-26(11-20(17)23)32-16-33-27/h4-8,10-13,17,22,28H,9,14-16H2,1-3H3/t17-,22-,28-/m0/s1
InChIKey KDWXRJQJWMAHSW-BZWCRFLISA-N
Molecular Weight 443.543 g/mol
SMILES [C@@]12(N(Cc3c([C@@]1(C[C@@](c1c2cc2c(c1)OCO2)(C)[H])[H])cc(c(c3)OC)OC)Cc1ccccc1)[H]
SPLASH splash10-00mo-9612200000-ef436f901995cb827c75
Source of Spectrum QC-10-1958-8
Synonyms (4bS,6S,11bS)-12-benzyl-2,3-dimethoxy-6-methyl-4b,5,6,11b,12,13-hexahydro[1,3]benzodioxolo[5,6-c]phenanthridine
Wiley ID 871409