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Spiro[1H,15AH-furo[2',3':7,8]indolizino[8,1-cd]carbazole-2(2ah),6'(7'H)-[4H,5H,15AH,16H]furo[2',3':7,8]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole], 12-demethylvobtusine
SpectraBase Compound ID 46mekYc4kyP
InChI InChI=1S/C42H48N4O6/c1-50-33(48)25-21-39-13-18-52-36(39)37(22-45-15-10-40(34(39)45)26-5-2-3-7-28(26)43-32(25)40)19-24-20-38-12-17-51-30(38)9-14-44-16-11-41(35(38)44)27-6-4-8-29(47)31(27)46(23-37)42(24,41)49/h2-8,24,30,34-36,43,47,49H,9-23H2,1H3/t24?,30?,34?,35?,36?,37?,38?,39?,40?,41-,42?/m0/s1
InChIKey DRHUYUGRSNMYON-YKJNLCRSSA-N
Mol Weight 704.9 g/mol
Molecular Formula C42H48N4O6
Exact Mass 704.357385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3uWocuBGYgA
Name Spiro[1H,15AH-furo[2',3':7,8]indolizino[8,1-cd]carbazole-2(2ah),6'(7'H)-[4H,5H,15AH,16H]furo[2',3':7,8]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole], 12-demethylvobtusine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 704.357385276 u
Formula C42H48N4O6
InChI InChI=1S/C42H48N4O6/c1-50-33(48)25-21-39-13-18-52-36(39)37(22-45-15-10-40(34(39)45)26-5-2-3-7-28(26)43-32(25)40)19-24-20-38-12-17-51-30(38)9-14-44-16-11-41(35(38)44)27-6-4-8-29(47)31(27)46(23-37)42(24,41)49/h2-8,24,30,34-36,43,47,49H,9-23H2,1H3/t24?,30?,34?,35?,36?,37?,38?,39?,40?,41-,42?/m0/s1
InChIKey DRHUYUGRSNMYON-YKJNLCRSSA-N
Molecular Weight 704.868 g/mol
SMILES [C@@]123C4(N(CC5(CC4CC46C1N(CCC4OCC6)CC3)C1C3(CC(C(=O)OC)=C4C6(C3N(C5)CC6)C=3C(=CC=CC3)N4)CCO1)C1=C2C=CC=C1O)O