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1,1'-{[(1-alpha,2-alpha,3-beta,4-beta)-2-(7-Methoxy-1,3-benzodioxol-5-yl)-4-(3,4,5-trimethoxyphenyl)cyclobutane-1,3-diyl]-dicarbonyl}bis[5,6-dihydropyridin-2(1H)-one]
SpectraBase Compound ID AgshJZXosaA
InChI InChI=1S/C33H34N2O10/c1-40-20-13-18(14-21(41-2)30(20)43-4)26-28(32(38)34-11-7-5-9-24(34)36)27(29(26)33(39)35-12-8-6-10-25(35)37)19-15-22(42-3)31-23(16-19)44-17-45-31/h5-6,9-10,13-16,26-29H,7-8,11-12,17H2,1-4H3/t26-,27-,28-,29-/m1/s1
InChIKey RANXPERGLCULGS-CXDXLJMYSA-N
Mol Weight 618.6 g/mol
Molecular Formula C33H34N2O10
Exact Mass 618.221345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPCwcc65zjK
Name 1,1'-{[(1-alpha,2-alpha,3-beta,4-beta)-2-(7-Methoxy-1,3-benzodioxol-5-yl)-4-(3,4,5-trimethoxyphenyl)cyclobutane-1,3-diyl]-dicarbonyl}bis[5,6-dihydropyridin-2(1H)-one]
Alternate Name(s) Piperarboresine 1,1'-((1R,2R,3R,4R)-2-(7-methoxybenzo[d][1,3]dioxol-5-yl)-4-(3,4,5-trimethoxyphenyl)cyclobutane-1,3-dicarbonyl)bis(5,6-dihydropyridin-2(1H)-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H34N2O10
InChI InChI=1S/C33H34N2O10/c1-40-20-13-18(14-21(41-2)30(20)43-4)26-28(32(38)34-11-7-5-9-24(34)36)27(29(26)33(39)35-12-8-6-10-25(35)37)19-15-22(42-3)31-23(16-19)44-17-45-31/h5-6,9-10,13-16,26-29H,7-8,11-12,17H2,1-4H3/t26-,27-,28-,29-/m1/s1
InChIKey RANXPERGLCULGS-CXDXLJMYSA-N
Literature Reference DOI 10.1002/hlca.200490044
Molecular Weight 618.639 g/mol
SMILES [C@]1([C@]([C@@]([C@@]1(c1cc(c(c(c1)OC)OC)OC)[H])(C(=O)N1CCC=CC1=O)[H])(c1cc2OCOc2c(c1)OC)[H])(C(=O)N1CCC=CC1=O)[H]
SPLASH splash10-014i-3239000000-03f4d2b6c0292e88ac08
Source of Spectrum H-87-468-3
Wiley ID 1785419