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2'-NORTILIACORININE
SpectraBase Compound ID 22OvDHC5KzS
InChI InChI=1S/C35H34N2O5/c1-37-11-9-22-17-32(40-3)34-35-33(22)27(37)15-20-5-7-29(39-2)25(13-20)24-12-19(4-6-28(24)38)14-26-23-18-31(42-35)30(41-34)16-21(23)8-10-36-26/h4-7,12-13,16-18,26-27,36,38H,8-11,14-15H2,1-3H3/t26-,27-/m0/s1
InChIKey DOUULZLWVARYRD-SVBPBHIXSA-N
Mol Weight 562.7 g/mol
Molecular Formula C35H34N2O5
Exact Mass 562.246772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gl4wAzwA2i0
Name 1S,1'S-Nortiliacorinin A
Alternate Name(s) (4(1)S,4(12)S)-2(6),4(6)-dimethoxy-4(2)-methyl-4(1),4(2),4(3),4(4),4(9),4(10),4(11),4(12)-octahydro-4(1,12)-[1,4]dioxino[2,3-g:6,5-h']diisoquinolina-1,2(1,3)-dibenzenacyclopentaphan-1(6)-ol
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Formula C35H34N2O5
InChI InChI=1S/C35H34N2O5/c1-37-11-9-22-17-32(40-3)34-35-33(22)27(37)15-20-5-7-29(39-2)25(13-20)24-12-19(4-6-28(24)38)14-26-23-18-31(42-35)30(41-34)16-21(23)8-10-36-26/h4-7,12-13,16-18,26-27,36,38H,8-11,14-15H2,1-3H3/t26-,27-/m0/s1
InChIKey DOUULZLWVARYRD-SVBPBHIXSA-N
Molecular Weight 562.666 g/mol
SMILES N1CCc2cc3c4Oc5c6[C@](Cc7ccc(c(-c8c(ccc(C[C@]1(c2c4)[H])c8)O)c7)OC)(N(CCc6cc(c5O3)OC)C)[H]
SPLASH splash10-03dr-0106090000-0190d3c8b3938170dced
Source of Spectrum APC-319-132-2
Wiley ID 1788219